2-[(6-methyl-2-oxidanyl-4-oxidanylidene-1H-pyridin-3-yl)sulfanyl]benzoic acid

Systemtic Name: 2-[(6-methyl-2-oxidanyl-4-oxidanylidene-1H-pyridin-3-yl)sulfanyl]benzoic acid Openeye Name: 2-[(2-hydroxy-6-methyl-4-oxo-1H-pyridin-3-yl)sulfanyl]benzoic acid CAS Name: 2-[(2-hydroxy-6-methyl-4-oxo-1H-pyridin-3-yl)thio]benzoic acid IUPAC Name: 2-[(2-hydroxy-6-methyl-4-oxo-1H-pyridin-3-yl)sulfanyl]benzoic acid Traditional Name: 2-[(2-hydroxy-4-keto-6-methyl-1H-pyridin-3-yl)thio]benzoic acid Formula: C13H11NO4S MolecularWeight: 277.29574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(N1)O)SC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=CC(=O)C(=C(N1)O)SC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C13H11NO4S/c1-7-6-9(15)11(12(16)14-7)19-10-5-3-2-4-8(10)13(17)18/h2-6H,1H3,(H,17,18)(H2,14,15,16)