2-[(3-methoxyphenyl)methylsulfanyl]pyridine-3-carboxylic acid

Systemtic Name: 2-[(3-methoxyphenyl)methylsulfanyl]pyridine-3-carboxylic acid Openeye Name: 2-[(3-methoxyphenyl)methylsulfanyl]pyridine-3-carboxylic acid CAS Name: 2-[(3-methoxyphenyl)methylthio]-3-pyridinecarboxylic acid IUPAC Name: 2-[(3-methoxyphenyl)methylsulfanyl]pyridine-3-carboxylic acid Traditional Name: 2-(m-anisylthio)nicotinic acid Formula: C14H13NO3S MolecularWeight: 275.32292

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)CSC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C14H13NO3S/c1-18-11-5-2-4-10(8-11)9-19-13-12(14(16)17)6-3-7-15-13/h2-8H,9H2,1H3,(H,16,17)