2-(4-chlorophenyl)-1-cyclohexyl-6-[[3-(4-oxidanylidenepiperidin-1-yl)carbonylphenyl]methoxy]-4-phenyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-(4-chlorophenyl)-1-cyclohexyl-6-[[3-(4-oxidanylidenepiperidin-1-yl)carbonylphenyl]methoxy]-4-phenyl-benzimidazole-5-carboxylic acid Openeye Name: 2-(4-chlorophenyl)-1-cyclohexyl-6-[[3-(4-oxopiperidine-1-carbonyl)phenyl]methoxy]-4-phenyl-benzimidazole-5-carboxylic acid CAS Name: 2-(4-chlorophenyl)-1-cyclohexyl-6-[[3-[oxo-(4-oxo-1-piperidinyl)methyl]phenyl]methoxy]-4-phenyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-(4-chlorophenyl)-1-cyclohexyl-6-[[3-(4-oxopiperidine-1-carbonyl)phenyl]methoxy]-4-phenylbenzimidazole-5-carboxylic acid Traditional Name: 2-(4-chlorophenyl)-1-cyclohexyl-6-[3-(4-ketopiperidine-1-carbonyl)benzyl]oxy-4-phenyl-benzimidazole-5-carboxylic acid Formula: C39H36ClN3O5 MolecularWeight: 662.17324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=CC(=C(C(=C3N=C2C4=CC=C(C=C4)Cl)C5=CC=CC=C5)C(=O)O)OCC6=CC=CC(=C6)C(=O)N7CCC(=O)CC7

Isomeric SMILES

C1CCC(CC1)N2C3=CC(=C(C(=C3N=C2C4=CC=C(C=C4)Cl)C5=CC=CC=C5)C(=O)O)OCC6=CC=CC(=C6)C(=O)N7CCC(=O)CC7

InChI

InChI=1S/C39H36ClN3O5/c40-29-16-14-27(15-17-29)37-41-36-32(43(37)30-12-5-2-6-13-30)23-33(35(39(46)47)34(36)26-9-3-1-4-10-26)48-24-25-8-7-11-28(22-25)38(45)42-20-18-31(44)19-21-42/h1,3-4,7-11,14-17,22-23,30H,2,5-6,12-13,18-21,24H2,(H,46,47)