3-[(4-methoxyphenyl)methylsulfanyl]pyridine-2-carboxylic acid

Systemtic Name: 3-[(4-methoxyphenyl)methylsulfanyl]pyridine-2-carboxylic acid Openeye Name: 3-[(4-methoxyphenyl)methylsulfanyl]pyridine-2-carboxylic acid CAS Name: 3-[(4-methoxyphenyl)methylthio]-2-pyridinecarboxylic acid IUPAC Name: 3-[(4-methoxyphenyl)methylsulfanyl]pyridine-2-carboxylic acid Traditional Name: 3-(p-anisylthio)picolinic acid Formula: C14H13NO3S MolecularWeight: 275.32292

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2=C(N=CC=C2)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CSC2=C(N=CC=C2)C(=O)O

InChI

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