4-[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxidanylidene-butanoic acid Openeye Name: 4-[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxo-butanoic acid CAS Name: 4-[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio]-3-oxobutanoic acid IUPAC Name: 4-[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxobutanoic acid Traditional Name: 4-[(3-cyano-4-phenyl-1-pyrindan-2-yl)thio]-3-keto-butyric acid Formula: C19H16N2O3S MolecularWeight: 352.40694

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)N=C(C(=C2C3=CC=CC=C3)C#N)SCC(=O)CC(=O)O

Isomeric SMILES

C1CC2=C(C1)N=C(C(=C2C3=CC=CC=C3)C#N)SCC(=O)CC(=O)O

InChI

InChI=1S/C19H16N2O3S/c20-10-15-18(12-5-2-1-3-6-12)14-7-4-8-16(14)21-19(15)25-11-13(22)9-17(23)24/h1-3,5-6H,4,7-9,11H2,(H,23,24)