5-chloranyl-6-(4-methoxyphenyl)sulfanyl-pyridine-3-carboxylic acid

Systemtic Name: 5-chloranyl-6-(4-methoxyphenyl)sulfanyl-pyridine-3-carboxylic acid Openeye Name: 5-chloro-6-(4-methoxyphenyl)sulfanyl-pyridine-3-carboxylic acid CAS Name: 5-chloro-6-[(4-methoxyphenyl)thio]-3-pyridinecarboxylic acid IUPAC Name: 5-chloro-6-(4-methoxyphenyl)sulfanylpyridine-3-carboxylic acid Traditional Name: 5-chloro-6-[(4-methoxyphenyl)thio]nicotinic acid Formula: C13H10ClNO3S MolecularWeight: 295.7414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SC2=C(C=C(C=N2)C(=O)O)Cl

Isomeric SMILES

COC1=CC=C(C=C1)SC2=C(C=C(C=N2)C(=O)O)Cl

InChI

InChI=1S/C13H10ClNO3S/c1-18-9-2-4-10(5-3-9)19-12-11(14)6-8(7-15-12)13(16)17/h2-7H,1H3,(H,16,17)