methyl 2-(phenylmethyl)sulfonylpyridine-3-carboxylate

Systemtic Name: methyl 2-(phenylmethyl)sulfonylpyridine-3-carboxylate Openeye Name: methyl 2-benzylsulfonylpyridine-3-carboxylate CAS Name: 2-(phenylmethyl)sulfonyl-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 2-benzylsulfonylpyridine-3-carboxylate Traditional Name: 2-benzylsulfonylnicotinic acid methyl ester Formula: C14H13NO4S MolecularWeight: 291.32232

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N=CC=C1)S(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(N=CC=C1)S(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C14H13NO4S/c1-19-14(16)12-8-5-9-15-13(12)20(17,18)10-11-6-3-2-4-7-11/h2-9H,10H2,1H3