2-(4-chlorophenyl)-1-cyclohexyl-6-[[3-[methyl-(phenylmethyl)carbamoyl]phenyl]methoxy]-4-phenyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-(4-chlorophenyl)-1-cyclohexyl-6-[[3-[methyl-(phenylmethyl)carbamoyl]phenyl]methoxy]-4-phenyl-benzimidazole-5-carboxylic acid Openeye Name: 6-[[3-[benzyl(methyl)carbamoyl]phenyl]methoxy]-2-(4-chlorophenyl)-1-cyclohexyl-4-phenyl-benzimidazole-5-carboxylic acid CAS Name: 2-(4-chlorophenyl)-1-cyclohexyl-6-[[3-[[methyl-(phenylmethyl)amino]-oxomethyl]phenyl]methoxy]-4-phenyl-5-benzimidazolecarboxylic acid IUPAC Name: 6-[[3-[benzyl(methyl)carbamoyl]phenyl]methoxy]-2-(4-chlorophenyl)-1-cyclohexyl-4-phenylbenzimidazole-5-carboxylic acid Traditional Name: 6-[3-[benzyl(methyl)carbamoyl]benzyl]oxy-2-(4-chlorophenyl)-1-cyclohexyl-4-phenyl-benzimidazole-5-carboxylic acid Formula: C42H38ClN3O4 MolecularWeight: 684.22182

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C2=CC(=CC=C2)COC3=C(C(=C4C(=C3)N(C(=N4)C5=CC=C(C=C5)Cl)C6CCCCC6)C7=CC=CC=C7)C(=O)O

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)C2=CC(=CC=C2)COC3=C(C(=C4C(=C3)N(C(=N4)C5=CC=C(C=C5)Cl)C6CCCCC6)C7=CC=CC=C7)C(=O)O

InChI

InChI=1S/C42H38ClN3O4/c1-45(26-28-12-5-2-6-13-28)41(47)32-17-11-14-29(24-32)27-50-36-25-35-39(37(38(36)42(48)49)30-15-7-3-8-16-30)44-40(31-20-22-33(43)23-21-31)46(35)34-18-9-4-10-19-34/h2-3,5-8,11-17,20-25,34H,4,9-10,18-19,26-27H2,1H3,(H,48,49)