methyl 6-(3-methylsulfonylphenyl)pyridine-3-carboxylate

Systemtic Name: methyl 6-(3-methylsulfonylphenyl)pyridine-3-carboxylate Openeye Name: methyl 6-(3-methylsulfonylphenyl)pyridine-3-carboxylate CAS Name: 6-(3-methylsulfonylphenyl)-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-(3-methylsulfonylphenyl)pyridine-3-carboxylate Traditional Name: 6-(3-mesylphenyl)nicotinic acid methyl ester Formula: C14H13NO4S MolecularWeight: 291.32232

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(C=C1)C2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CN=C(C=C1)C2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C14H13NO4S/c1-19-14(16)11-6-7-13(15-9-11)10-4-3-5-12(8-10)20(2,17)18/h3-9H,1-2H3