[4-(2-cyanophenyl)phenyl]methyl 3,4-dimethyl-5-sulfamoyl-benzoate

Systemtic Name: [4-(2-cyanophenyl)phenyl]methyl 3,4-dimethyl-5-sulfamoyl-benzoate Openeye Name: [4-(2-cyanophenyl)phenyl]methyl 3,4-dimethyl-5-sulfamoyl-benzoate CAS Name: 3,4-dimethyl-5-sulfamoylbenzoic acid [4-(2-cyanophenyl)phenyl]methyl ester IUPAC Name: [4-(2-cyanophenyl)phenyl]methyl 3,4-dimethyl-5-sulfamoylbenzoate Traditional Name: 3,4-dimethyl-5-sulfamoyl-benzoic acid [4-(2-cyanophenyl)benzyl] ester Formula: C23H20N2O4S MolecularWeight: 420.4809

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3C#N)S(=O)(=O)N)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3C#N)S(=O)(=O)N)C

InChI

InChI=1S/C23H20N2O4S/c1-15-11-20(12-22(16(15)2)30(25,27)28)23(26)29-14-17-7-9-18(10-8-17)21-6-4-3-5-19(21)13-24/h3-12H,14H2,1-2H3,(H2,25,27,28)