3-(1-oxidanylidene-3,4-dihydrothiopyrano[3,4-b]indol-9-yl)benzoic acid

Systemtic Name: 3-(1-oxidanylidene-3,4-dihydrothiopyrano[3,4-b]indol-9-yl)benzoic acid Openeye Name: 3-(1-oxo-3,4-dihydrothiopyrano[3,4-b]indol-9-yl)benzoic acid CAS Name: 3-(1-oxo-3,4-dihydrothiopyrano[3,4-b]indol-9-yl)benzoic acid IUPAC Name: 3-(1-oxo-3,4-dihydrothiopyrano[3,4-b]indol-9-yl)benzoic acid Traditional Name: 3-(1-keto-3,4-dihydrothiopyran[3,4-b]indol-9-yl)benzoic acid Formula: C18H13NO3S MolecularWeight: 323.36572

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=O)C2=C1C3=CC=CC=C3N2C4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1CSC(=O)C2=C1C3=CC=CC=C3N2C4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C18H13NO3S/c20-17(21)11-4-3-5-12(10-11)19-15-7-2-1-6-13(15)14-8-9-23-18(22)16(14)19/h1-7,10H,8-9H2,(H,20,21)