2-(4-methoxycarbonylphenyl)sulfanyl-6-methyl-pyridine-3-carboxylic acid

Systemtic Name: 2-(4-methoxycarbonylphenyl)sulfanyl-6-methyl-pyridine-3-carboxylic acid Openeye Name: 2-(4-methoxycarbonylphenyl)sulfanyl-6-methyl-pyridine-3-carboxylic acid CAS Name: 2-[(4-methoxycarbonylphenyl)thio]-6-methyl-3-pyridinecarboxylic acid IUPAC Name: 2-(4-methoxycarbonylphenyl)sulfanyl-6-methylpyridine-3-carboxylic acid Traditional Name: 2-[(4-carbomethoxyphenyl)thio]-6-methyl-nicotinic acid Formula: C15H13NO4S MolecularWeight: 303.33302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)O)SC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)O)SC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C15H13NO4S/c1-9-3-8-12(14(17)18)13(16-9)21-11-6-4-10(5-7-11)15(19)20-2/h3-8H,1-2H3,(H,17,18)