[4-(2-cyanophenyl)phenyl]methyl 2-methylsulfonylbenzoate

Systemtic Name: [4-(2-cyanophenyl)phenyl]methyl 2-methylsulfonylbenzoate Openeye Name: [4-(2-cyanophenyl)phenyl]methyl 2-methylsulfonylbenzoate CAS Name: 2-methylsulfonylbenzoic acid [4-(2-cyanophenyl)phenyl]methyl ester IUPAC Name: [4-(2-cyanophenyl)phenyl]methyl 2-methylsulfonylbenzoate Traditional Name: 2-mesylbenzoic acid [4-(2-cyanophenyl)benzyl] ester Formula: C22H17NO4S MolecularWeight: 391.43968

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3C#N

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3C#N

InChI

InChI=1S/C22H17NO4S/c1-28(25,26)21-9-5-4-8-20(21)22(24)27-15-16-10-12-17(13-11-16)19-7-3-2-6-18(19)14-23/h2-13H,15H2,1H3