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 9 results

Search term: PYJIWOQTJHPDAK (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
397835

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H15N5O2/c12-10-9-11(14-4-13-10)16(5-15-9)8-1-6(2-17)7(8)3-18/h4-8,17-18H,1-3H2,(H2,12,13,14)/t6-,7-,8-/m1/s1
C11H15N5O2249.2691141000
10143525

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H15N5O2/c12-10-9-11(14-4-13-10)16(5-15-9)8-1-6(2-17)7(8)3-18/h4-8,17-18H,1-3H2,(H2,12,13,14)/t6-,7-,8+/m1/s1
C11H15N5O2249.26916700
108901

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C11H15N5O2/c12-10-9-11(14-4-13-10)16(5-15-9)8-1-6(2-17)7(8)3-18/h4-8,17-18H,1-3H2,(H2,12,13,14)
C11H15N5O2249.26916500
2271958

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H15N5O2/c12-10-9-11(14-4-13-10)16(5-15-9)8-1-6(2-17)7(8)3-18/h4-8,17-18H,1-3H2,(H2,12,13,14)/t6-,7+,8-/m1/s1
C11H15N5O2249.26913300
8374340

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C11H15N5O2/c12-10-9-11(14-4-13-10)16(5-15-9)8-1-6(2-17)7(8)3-18/h4-8,17-18H,1-3H2,(H2,12,13,14)/t6-,7-,8?/m1/s1
C11H15N5O2249.26912100
8737956

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H15N5O2/c12-10-9-11(14-4-13-10)16(5-15-9)8-1-6(2-17)7(8)3-18/h4-8,17-18H,1-3H2,(H2,12,13,14)/t6-,7+,8+/m1/s1
C11H15N5O2249.26912100
23128384

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C11H15N5O2/c12-10-9-11(14-4-13-10)16(5-15-9)8-1-6(2-17)7(8)3-18/h4-8,17-18H,1-3H2,(H2,12,13,14)/t6-,7-,8?/m0/s1
C11H15N5O2249.26912200
23128809

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C11H15N5O2/c12-10-9-11(14-4-13-10)16(5-15-9)8-1-6(2-17)7(8)3-18/h4-8,17-18H,1-3H2,(H2,12,13,14)/t6-,7?,8?/m1/s1
C11H15N5O2249.26912200
21202991

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C11H15N5O2/c12-10-9-11(14-4-13-10)16(5-15-9)8-1-6(2-17)7(8)3-18/h4-8,17-18H,1-3H2,(H2,12,13,14)/t6-,7-,8-/m0/s1
C11H15N5O2249.26911500

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