2-(1-methyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)sulfanylbenzoate

Systemtic Name: 2-(1-methyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)sulfanylbenzoate Openeye Name: 2-[(2-hydroxy-1-methyl-4-oxo-3-quinolyl)sulfanyl]benzoate CAS Name: 2-[(2-hydroxy-1-methyl-4-oxo-3-quinolinyl)thio]benzoate IUPAC Name: 2-(2-hydroxy-1-methyl-4-oxoquinolin-3-yl)sulfanylbenzoate Traditional Name: 2-[(2-hydroxy-4-keto-1-methyl-3-quinolyl)thio]benzoate Formula: C17H12NO4S- MolecularWeight: 326.34648

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=O)C(=C1O)SC3=CC=CC=C3C(=O)[O-]

Isomeric SMILES

CN1C2=CC=CC=C2C(=O)C(=C1O)SC3=CC=CC=C3C(=O)[O-]

InChI

InChI=1S/C17H13NO4S/c1-18-12-8-4-2-6-10(12)14(19)15(16(18)20)23-13-9-5-3-7-11(13)17(21)22/h2-9,20H,1H3,(H,21,22)/p-1