2-[4-[[2-(4-chlorophenyl)-5-ethoxycarbonyl-phenyl]methoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[4-[[2-(4-chlorophenyl)-5-ethoxycarbonyl-phenyl]methoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[4-[[2-(4-chlorophenyl)-5-ethoxycarbonyl-phenyl]methoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 2-[4-[[2-(4-chlorophenyl)-5-ethoxycarbonylphenyl]methoxy]phenyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[4-[[2-(4-chlorophenyl)-5-ethoxycarbonylphenyl]methoxy]phenyl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[4-[5-carbethoxy-2-(4-chlorophenyl)benzyl]oxyphenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C36H33ClN2O5 MolecularWeight: 609.11062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)C2=CC=C(C=C2)Cl)COC3=CC=C(C=C3)C4=NC5=C(N4C6CCCCC6)C=CC(=C5)C(=O)O

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)C2=CC=C(C=C2)Cl)COC3=CC=C(C=C3)C4=NC5=C(N4C6CCCCC6)C=CC(=C5)C(=O)O

InChI

InChI=1S/C36H33ClN2O5/c1-2-43-36(42)26-12-18-31(23-8-14-28(37)15-9-23)27(20-26)22-44-30-16-10-24(11-17-30)34-38-32-21-25(35(40)41)13-19-33(32)39(34)29-6-4-3-5-7-29/h8-21,29H,2-7,22H2,1H3,(H,40,41)