2-(1,6-dimethyl-2-oxidanyl-4-oxidanylidene-pyridin-3-yl)sulfanylbenzoic acid

Systemtic Name: 2-(1,6-dimethyl-2-oxidanyl-4-oxidanylidene-pyridin-3-yl)sulfanylbenzoic acid Openeye Name: 2-[(2-hydroxy-1,6-dimethyl-4-oxo-3-pyridyl)sulfanyl]benzoic acid CAS Name: 2-[(2-hydroxy-1,6-dimethyl-4-oxo-3-pyridinyl)thio]benzoic acid IUPAC Name: 2-(2-hydroxy-1,6-dimethyl-4-oxopyridin-3-yl)sulfanylbenzoic acid Traditional Name: 2-[(2-hydroxy-4-keto-1,6-dimethyl-3-pyridyl)thio]benzoic acid Formula: C14H13NO4S MolecularWeight: 291.32232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(N1C)O)SC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=CC(=O)C(=C(N1C)O)SC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C14H13NO4S/c1-8-7-10(16)12(13(17)15(8)2)20-11-6-4-3-5-9(11)14(18)19/h3-7,17H,1-2H3,(H,18,19)