4-(3-cyanophenyl)-1-[[4-(2-sulfamoylphenyl)phenyl]methyl]pyrrolidine-3-carboxylic acid

Systemtic Name: 4-(3-cyanophenyl)-1-[[4-(2-sulfamoylphenyl)phenyl]methyl]pyrrolidine-3-carboxylic acid Openeye Name: 4-(3-cyanophenyl)-1-[[4-(2-sulfamoylphenyl)phenyl]methyl]pyrrolidine-3-carboxylic acid CAS Name: 4-(3-cyanophenyl)-1-[[4-(2-sulfamoylphenyl)phenyl]methyl]-3-pyrrolidinecarboxylic acid IUPAC Name: 4-(3-cyanophenyl)-1-[[4-(2-sulfamoylphenyl)phenyl]methyl]pyrrolidine-3-carboxylic acid Traditional Name: 4-(3-cyanophenyl)-1-[4-(2-sulfamoylphenyl)benzyl]pyrrolidine-3-carboxylic acid Formula: C25H23N3O4S MolecularWeight: 461.53282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CN1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)N)C(=O)O)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1C(C(CN1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)N)C(=O)O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C25H23N3O4S/c26-13-18-4-3-5-20(12-18)22-15-28(16-23(22)25(29)30)14-17-8-10-19(11-9-17)21-6-1-2-7-24(21)33(27,31)32/h1-12,22-23H,14-16H2,(H,29,30)(H2,27,31,32)