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 3 results

Search term: NVSJOASGKCGXBZ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8107691

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C25H17N3O4/c29-10-11-9-16-27-14-7-3-1-5-12(14)17-19-20(24(31)26-23(19)30)18-13-6-2-4-8-15(13)28(25(11)32-16)22(18)21(17)27/h1-8,11,16,25,29H,9-10H2,(H,26,30,31)/t11-,16+,25-/m1/s1
C25H17N3O4423.42026500
23135061

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C25H17N3O4/c29-10-11-9-16-27-14-7-3-1-5-12(14)17-19-20(24(31)26-23(19)30)18-13-6-2-4-8-15(13)28(25(11)32-16)22(18)21(17)27/h1-8,11,16,25,29H,9-10H2,(H,26,30,31)/t11-,16-,25+/m0/s1
C25H17N3O4423.42022200
34973732

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C25H17N3O4/c29-10-11-9-16-27-14-7-3-1-5-12(14)17-19-20(24(31)26-23(19)30)18-13-6-2-4-8-15(13)28(25(11)32-16)22(18)21(17)27/h1-8,11,16,25,29H,9-10H2,(H,26,30,31)/t11-,16?,25-/m1/s1
C25H17N3O4423.42021100

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