(3-methoxycarbonylphenyl)methyl 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: (3-methoxycarbonylphenyl)methyl 2-methylsulfanylpyridine-3-carboxylate Openeye Name: (3-methoxycarbonylphenyl)methyl 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid (3-methoxycarbonylphenyl)methyl ester IUPAC Name: (3-methoxycarbonylphenyl)methyl 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid (3-carbomethoxybenzyl) ester Formula: C16H15NO4S MolecularWeight: 317.3596

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)COC(=O)C2=C(N=CC=C2)SC

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)COC(=O)C2=C(N=CC=C2)SC

InChI

InChI=1S/C16H15NO4S/c1-20-15(18)12-6-3-5-11(9-12)10-21-16(19)13-7-4-8-17-14(13)22-2/h3-9H,10H2,1-2H3