2-(4-ethanoylphenyl)sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-(4-ethanoylphenyl)sulfanylpyridine-3-carboxylic acid Openeye Name: 2-(4-acetylphenyl)sulfanylpyridine-3-carboxylic acid CAS Name: 2-[(4-acetylphenyl)thio]-3-pyridinecarboxylic acid IUPAC Name: 2-(4-acetylphenyl)sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[(4-acetylphenyl)thio]nicotinic acid Formula: C14H11NO3S MolecularWeight: 273.30704

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C14H11NO3S/c1-9(16)10-4-6-11(7-5-10)19-13-12(14(17)18)3-2-8-15-13/h2-8H,1H3,(H,17,18)