Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 27 results

Search term: NLVFBUXFDBBNBW (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
33377

14 of 14 defined stereocentres - 14/14 defined
InChI=1/C18H37N5O9/c19-3-9-8(25)2-7(22)17(29-9)31-15-5(20)1-6(21)16(14(15)28)32-18-13(27)11(23)12(26)10(4-24)30-18/h5-18,24-28H,1-4,19-23H2/t5-,6+,7+,8-,9+,10+,11-,12+,13+,14-,15+,16-,17+,18+/m0/s1
C18H37N5O9467.5145120155508447
5295

0 of 14 defined stereocentres - 0/14 defined
InChI=1/C18H37N5O9/c19-3-9-8(25)2-7(22)17(29-9)31-15-5(20)1-6(21)16(14(15)28)32-18-13(27)11(23)12(26)10(4-24)30-18/h5-18,24-28H,1-4,19-23H2
C18H37N5O9467.514530352800
17464290

14 of 14 defined stereocentres - 14/14 defined
InChI=1/C18H37N5O9/c19-3-9-8(25)2-7(22)17(29-9)31-15-5(20)1-6(21)16(14(15)28)32-18-13(27)11(23)12(26)10(4-24)30-18/h5-18,24-28H,1-4,19-23H2/t5-,6+,7-,8+,9-,10+,11+,12+,13+,14-,15+,16-,17+,18+/m0/s1
C18H37N5O9467.514510500
17347329

14 of 14 defined stereocentres - 14/14 defined
InChI=1/C18H37N5O9/c19-3-9-8(25)2-7(22)17(29-9)31-15-5(20)1-6(21)16(14(15)28)32-18-13(27)11(23)12(26)10(4-24)30-18/h5-18,24-28H,1-4,19-23H2/t5-,6+,7+,8-,9+,10+,11+,12+,13+,14-,15+,16-,17+,18+/m0/s1
C18H37N5O9467.514561400
17460054

11 of 14 defined stereocentres - 11/14 defined
InChI=1/C18H37N5O9/c19-3-9-8(25)2-7(22)17(29-9)31-15-5(20)1-6(21)16(14(15)28)32-18-13(27)11(23)12(26)10(4-24)30-18/h5-18,24-28H,1-4,19-23H2/t5?,6?,7-,8+,9-,10+,11+,12+,13+,14?,15+,16-,17-,18+/m0/s1
C18H37N5O9467.51456200
57267011

14 of 14 defined stereocentres - 14/14 defined
InChI=1/C18H37N5O9/c19-3-9-8(25)2-7(22)17(29-9)31-15-5(20)1-6(21)16(14(15)28)32-18-13(27)11(23)12(26)10(4-24)30-18/h5-18,24-28H,1-4,19-23H2/t5-,6+,7+,8-,9+,10+,11-,12+,13+,14-,15-,16-,17-,18-/m0/s1
C18H37N5O9467.51455400
64973329

13 of 14 defined stereocentres - 13/14 defined
InChI=1/C18H37N5O9/c19-3-9-8(25)2-7(22)17(29-9)31-15-5(20)1-6(21)16(14(15)28)32-18-13(27)11(23)12(26)10(4-24)30-18/h5-18,24-28H,1-4,19-23H2/t5-,6+,7+,8-,9+,10+,11-,12+,13?,14-,15+,16-,17-,18+/m0/s1
C18H37N5O9467.51453300
5036675

14 of 14 defined stereocentres - 14/14 defined
InChI=1/C18H37N5O9/c19-3-9-8(25)2-7(22)17(29-9)31-15-5(20)1-6(21)16(14(15)28)32-18-13(27)11(23)12(26)10(4-24)30-18/h5-18,24-28H,1-4,19-23H2/t5-,6+,7-,8+,9+,10-,11+,12-,13+,14+,15-,16-,17+,18+/m1/s1
C18H37N5O9467.51453300
7980373

13 of 14 defined stereocentres - 13/14 defined
InChI=1/C18H37N5O9/c19-3-9-8(25)2-7(22)17(29-9)31-15-5(20)1-6(21)16(14(15)28)32-18-13(27)11(23)12(26)10(4-24)30-18/h5-18,24-28H,1-4,19-23H2/t5-,6+,7+,8-,9+,10+,11-,12+,13+,14-,15+,16?,17+,18+/m0/s1
C18H37N5O9467.51453200
30783465

14 of 14 defined stereocentres - 14/14 defined
InChI=1/C18H37N5O9/c19-3-9-8(25)2-7(22)17(29-9)31-15-5(20)1-6(21)16(14(15)28)32-18-13(27)11(23)12(26)10(4-24)30-18/h5-18,24-28H,1-4,19-23H2/t5-,6-,7+,8+,9-,10-,11+,12-,13+,14-,15-,16+,17+,18+/m0/s1
C18H37N5O9467.51453200
8109913

13 of 14 defined stereocentres - 13/14 defined
InChI=1/C18H37N5O9/c19-3-9-8(25)2-7(22)17(29-9)31-15-5(20)1-6(21)16(14(15)28)32-18-13(27)11(23)12(26)10(4-24)30-18/h5-18,24-28H,1-4,19-23H2/t5-,6+,7+,8-,9+,10+,11-,12+,13+,14-,15+,16-,17+,18?/m0/s1
C18H37N5O9467.51452100
9515246

14 of 14 defined stereocentres - 14/14 defined
InChI=1/C18H37N5O9/c19-3-9-8(25)2-7(22)17(29-9)31-15-5(20)1-6(21)16(14(15)28)32-18-13(27)11(23)12(26)10(4-24)30-18/h5-18,24-28H,1-4,19-23H2/t5-,6+,7+,8-,9+,10-,11+,12-,13-,14-,15+,16-,17+,18-/m0/s1
C18H37N5O9467.51452100
21433338

Charge

0 of 14 defined stereocentres - 0/14 defined
InChI=1/C18H37N5O9/c19-3-9-8(25)2-7(22)17(29-9)31-15-5(20)1-6(21)16(14(15)28)32-18-13(27)11(23)12(26)10(4-24)30-18/h5-18,24-28H,1-4,19-23H2/p+5
C18H42N5O9472.55142200
110094561

14 of 14 defined stereocentres - 14/14 defined
InChI=1/C18H37N5O9/c19-3-9-8(25)2-7(22)17(29-9)31-15-5(20)1-6(21)16(14(15)28)32-18-13(27)11(23)12(26)10(4-24)30-18/h5-18,24-28H,1-4,19-23H2/t5-,6+,7+,8+,9+,10+,11-,12+,13-,14+,15+,16-,17+,18+/m0/s1
C18H37N5O9467.51451100
113607220

14 of 14 defined stereocentres - 14/14 defined
InChI=1/C18H37N5O9/c19-3-9-8(25)2-7(22)17(29-9)31-15-5(20)1-6(21)16(14(15)28)32-18-13(27)11(23)12(26)10(4-24)30-18/h5-18,24-28H,1-4,19-23H2/t5-,6+,7+,8+,9-,10+,11-,12+,13-,14+,15-,16-,17+,18-/m0/s1
C18H37N5O9467.51451100
114390132

14 of 14 defined stereocentres - 14/14 defined
InChI=1/C18H37N5O9/c19-3-9-8(25)2-7(22)17(29-9)31-15-5(20)1-6(21)16(14(15)28)32-18-13(27)11(23)12(26)10(4-24)30-18/h5-18,24-28H,1-4,19-23H2/t5-,6-,7+,8-,9+,10+,11-,12+,13+,14-,15+,16-,17-,18-/m0/s1
C18H37N5O9467.51451100
114391367

14 of 14 defined stereocentres - 14/14 defined
InChI=1/C18H37N5O9/c19-3-9-8(25)2-7(22)17(29-9)31-15-5(20)1-6(21)16(14(15)28)32-18-13(27)11(23)12(26)10(4-24)30-18/h5-18,24-28H,1-4,19-23H2/t5-,6-,7-,8-,9+,10+,11+,12+,13-,14+,15+,16+,17-,18-/m1/s1
C18H37N5O9467.51451100
114547664

13 of 14 defined stereocentres - 13/14 defined
InChI=1/C18H37N5O9/c19-3-9-8(25)2-7(22)17(29-9)31-15-5(20)1-6(21)16(14(15)28)32-18-13(27)11(23)12(26)10(4-24)30-18/h5-18,24-28H,1-4,19-23H2/t5-,6+,7+,8-,9+,10+,11-,12+,13+,14+,15+,16-,17?,18+/m0/s1
C18H37N5O9467.51451100
114953819

14 of 14 defined stereocentres - 14/14 defined
InChI=1/C18H37N5O9/c19-3-9-8(25)2-7(22)17(29-9)31-15-5(20)1-6(21)16(14(15)28)32-18-13(27)11(23)12(26)10(4-24)30-18/h5-18,24-28H,1-4,19-23H2/t5-,6-,7+,8+,9+,10+,11+,12-,13+,14+,15-,16-,17-,18-/m1/s1
C18H37N5O9467.51451100
12

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