(2-cyanophenyl) 3-(methylsulfonylmethyl)benzoate

Systemtic Name: (2-cyanophenyl) 3-(methylsulfonylmethyl)benzoate Openeye Name: (2-cyanophenyl) 3-(methylsulfonylmethyl)benzoate CAS Name: 3-(methylsulfonylmethyl)benzoic acid (2-cyanophenyl) ester IUPAC Name: (2-cyanophenyl) 3-(methylsulfonylmethyl)benzoate Traditional Name: 3-(mesylmethyl)benzoic acid (2-cyanophenyl) ester Formula: C16H13NO4S MolecularWeight: 315.34372

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=CC(=C1)C(=O)OC2=CC=CC=C2C#N

Isomeric SMILES

CS(=O)(=O)CC1=CC=CC(=C1)C(=O)OC2=CC=CC=C2C#N

InChI

InChI=1S/C16H13NO4S/c1-22(19,20)11-12-5-4-7-13(9-12)16(18)21-15-8-3-2-6-14(15)10-17/h2-9H,11H2,1H3