2-(4-tert-butylphenyl)-6-[(3-chlorophenyl)methoxy]-1-cyclohexyl-4-phenyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-(4-tert-butylphenyl)-6-[(3-chlorophenyl)methoxy]-1-cyclohexyl-4-phenyl-benzimidazole-5-carboxylic acid Openeye Name: 2-(4-tert-butylphenyl)-6-[(3-chlorophenyl)methoxy]-1-cyclohexyl-4-phenyl-benzimidazole-5-carboxylic acid CAS Name: 2-(4-tert-butylphenyl)-6-[(3-chlorophenyl)methoxy]-1-cyclohexyl-4-phenyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-(4-tert-butylphenyl)-6-[(3-chlorophenyl)methoxy]-1-cyclohexyl-4-phenylbenzimidazole-5-carboxylic acid Traditional Name: 2-(4-tert-butylphenyl)-6-(3-chlorobenzyl)oxy-1-cyclohexyl-4-phenyl-benzimidazole-5-carboxylic acid Formula: C37H37ClN2O3 MolecularWeight: 593.15428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C(=C(C=C3N2C4CCCCC4)OCC5=CC(=CC=C5)Cl)C(=O)O)C6=CC=CC=C6

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C(=C(C=C3N2C4CCCCC4)OCC5=CC(=CC=C5)Cl)C(=O)O)C6=CC=CC=C6

InChI

InChI=1S/C37H37ClN2O3/c1-37(2,3)27-19-17-26(18-20-27)35-39-34-30(40(35)29-15-8-5-9-16-29)22-31(43-23-24-11-10-14-28(38)21-24)33(36(41)42)32(34)25-12-6-4-7-13-25/h4,6-7,10-14,17-22,29H,5,8-9,15-16,23H2,1-3H3,(H,41,42)