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 5 results

Search term: PDEHXAAANCOGQN (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4686826

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C24H33N3O4/c1-14-7-15(2)19(16(3)8-14)27-21(30)18(20(29)26-22(27)31)11-25-13-24(6)10-17(28)9-23(4,5)12-24/h7-8,11,17,25,28H,9-10,12-13H2,1-6H3,(H,26,29,31)/b18-11-
C24H33N3O4427.5365161100
5205628

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C24H33N3O4/c1-14-7-15(2)19(16(3)8-14)27-21(30)18(20(29)26-22(27)31)11-25-13-24(6)10-17(28)9-23(4,5)12-24/h7-8,11,17,25,28H,9-10,12-13H2,1-6H3,(H,26,29,31)
C24H33N3O4427.53659700
4655756

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C24H33N3O4/c1-14-7-15(2)19(16(3)8-14)27-21(30)18(20(29)26-22(27)31)11-25-13-24(6)10-17(28)9-23(4,5)12-24/h7-8,11,17,25,28H,9-10,12-13H2,1-6H3,(H,26,29,31)/b18-11+
C24H33N3O4427.53658600
62583586

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C24H33N3O4/c1-14-7-15(2)19(16(3)8-14)27-21(30)18(20(29)26-22(27)31)11-25-13-24(6)10-17(28)9-23(4,5)12-24/h7-8,11,17,25,28H,9-10,12-13H2,1-6H3,(H,26,29,31)/b18-11-/t17-,24-/m1/s1
C24H33N3O4427.53652200
62674942

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C24H33N3O4/c1-14-7-15(2)19(16(3)8-14)27-21(30)18(20(29)26-22(27)31)11-25-13-24(6)10-17(28)9-23(4,5)12-24/h7-8,11,17,25,28H,9-10,12-13H2,1-6H3,(H,26,29,31)/b18-11-/t17-,24+/m0/s1
C24H33N3O4427.53652200

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