3-[4-[[2-(2-chlorophenyl)-3H-benzimidazol-5-yl]sulfamoyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[[2-(2-chlorophenyl)-3H-benzimidazol-5-yl]sulfamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[[2-(2-chlorophenyl)-3H-benzimidazol-5-yl]sulfamoyl]phenyl]propanoic acid CAS Name: 3-[4-[[2-(2-chlorophenyl)-3H-benzimidazol-5-yl]sulfamoyl]phenyl]propanoic acid IUPAC Name: 3-[4-[[2-(2-chlorophenyl)-3H-benzimidazol-5-yl]sulfamoyl]phenyl]propanoic acid Traditional Name: 3-[4-[[2-(2-chlorophenyl)-3H-benzimidazol-5-yl]sulfamoyl]phenyl]propionic acid Formula: C22H18ClN3O4S MolecularWeight: 455.91402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=C(N2)C=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)CCC(=O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=C(N2)C=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)CCC(=O)O)Cl

InChI

InChI=1S/C22H18ClN3O4S/c23-18-4-2-1-3-17(18)22-24-19-11-8-15(13-20(19)25-22)26-31(29,30)16-9-5-14(6-10-16)7-12-21(27)28/h1-6,8-11,13,26H,7,12H2,(H,24,25)(H,27,28)