(2-cyanophenyl)methyl 4-methylsulfonylbenzoate

Systemtic Name: (2-cyanophenyl)methyl 4-methylsulfonylbenzoate Openeye Name: (2-cyanophenyl)methyl 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid (2-cyanobenzyl) ester Formula: C16H13NO4S MolecularWeight: 315.34372

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC2=CC=CC=C2C#N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC2=CC=CC=C2C#N

InChI

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