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: TVFBYQKJTSMSMY (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2222533

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C18H19N3S/c1-2-14-8-6-7-11-16(14)20-18(22)21-17(12-13-19-21)15-9-4-3-5-10-15/h3-11,13,17H,2,12H2,1H3,(H,20,22)
C18H19N3S309.42856241800
820537

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H19N3S/c1-2-14-8-6-7-11-16(14)20-18(22)21-17(12-13-19-21)15-9-4-3-5-10-15/h3-11,13,17H,2,12H2,1H3,(H,20,22)/t17-/m1/s1
C18H19N3S309.42862100
820538

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H19N3S/c1-2-14-8-6-7-11-16(14)20-18(22)21-17(12-13-19-21)15-9-4-3-5-10-15/h3-11,13,17H,2,12H2,1H3,(H,20,22)/t17-/m0/s1
C18H19N3S309.42862100

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