cyanomethyl 3-[(4-chlorophenyl)-(phenylmethyl)sulfamoyl]benzoate

Systemtic Name: cyanomethyl 3-[(4-chlorophenyl)-(phenylmethyl)sulfamoyl]benzoate Openeye Name: cyanomethyl 3-[benzyl-(4-chlorophenyl)sulfamoyl]benzoate CAS Name: 3-[(4-chlorophenyl)-(phenylmethyl)sulfamoyl]benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-[benzyl-(4-chlorophenyl)sulfamoyl]benzoate Traditional Name: 3-[benzyl-(4-chlorophenyl)sulfamoyl]benzoic acid cyanomethyl ester Formula: C22H17ClN2O4S MolecularWeight: 440.89938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC(=C3)C(=O)OCC#N

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC(=C3)C(=O)OCC#N

InChI

InChI=1S/C22H17ClN2O4S/c23-19-9-11-20(12-10-19)25(16-17-5-2-1-3-6-17)30(27,28)21-8-4-7-18(15-21)22(26)29-14-13-24/h1-12,15H,14,16H2