methyl 2-[4-[[2-(4-chlorophenyl)-5-nitro-phenyl]methoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylate

Systemtic Name: methyl 2-[4-[[2-(4-chlorophenyl)-5-nitro-phenyl]methoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylate Openeye Name: methyl 2-[4-[[2-(4-chlorophenyl)-5-nitro-phenyl]methoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylate CAS Name: 2-[4-[[2-(4-chlorophenyl)-5-nitrophenyl]methoxy]phenyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[4-[[2-(4-chlorophenyl)-5-nitrophenyl]methoxy]phenyl]-1-cyclohexylbenzimidazole-5-carboxylate Traditional Name: 2-[4-[2-(4-chlorophenyl)-5-nitro-benzyl]oxyphenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid methyl ester Formula: C34H30ClN3O5 MolecularWeight: 596.0721

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N(C(=N2)C3=CC=C(C=C3)OCC4=C(C=CC(=C4)[N+](=O)[O-])C5=CC=C(C=C5)Cl)C6CCCCC6

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N(C(=N2)C3=CC=C(C=C3)OCC4=C(C=CC(=C4)[N+](=O)[O-])C5=CC=C(C=C5)Cl)C6CCCCC6

InChI

InChI=1S/C34H30ClN3O5/c1-42-34(39)24-11-18-32-31(20-24)36-33(37(32)27-5-3-2-4-6-27)23-9-15-29(16-10-23)43-21-25-19-28(38(40)41)14-17-30(25)22-7-12-26(35)13-8-22/h7-20,27H,2-6,21H2,1H3