2-[4-[[2-(4-aminocarbonylphenyl)-5-chloranyl-phenyl]methoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[4-[[2-(4-aminocarbonylphenyl)-5-chloranyl-phenyl]methoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[4-[[2-(4-carbamoylphenyl)-5-chloro-phenyl]methoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 2-[4-[[2-(4-carbamoylphenyl)-5-chlorophenyl]methoxy]phenyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[4-[[2-(4-carbamoylphenyl)-5-chlorophenyl]methoxy]phenyl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[4-[2-(4-carbamoylphenyl)-5-chloro-benzyl]oxyphenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C34H30ClN3O4 MolecularWeight: 580.0727

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)OCC5=C(C=CC(=C5)Cl)C6=CC=C(C=C6)C(=O)N

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)OCC5=C(C=CC(=C5)Cl)C6=CC=C(C=C6)C(=O)N

InChI

InChI=1S/C34H30ClN3O4/c35-26-13-16-29(21-6-8-22(9-7-21)32(36)39)25(18-26)20-42-28-14-10-23(11-15-28)33-37-30-19-24(34(40)41)12-17-31(30)38(33)27-4-2-1-3-5-27/h6-19,27H,1-5,20H2,(H2,36,39)(H,40,41)