methyl 2-(cyanomethylsulfonyl)benzoate

Systemtic Name: methyl 2-(cyanomethylsulfonyl)benzoate Openeye Name: methyl 2-(cyanomethylsulfonyl)benzoate CAS Name: 2-(cyanomethylsulfonyl)benzoic acid methyl ester IUPAC Name: methyl 2-(cyanomethylsulfonyl)benzoate Traditional Name: 2-(cyanomethylsulfonyl)benzoic acid methyl ester Formula: C10H9NO4S MolecularWeight: 239.24776

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)CC#N

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)CC#N

InChI

InChI=1S/C10H9NO4S/c1-15-10(12)8-4-2-3-5-9(8)16(13,14)7-6-11/h2-5H,7H2,1H3