2-[[1-cyclohexyl-2-(4-phenylmethoxyphenyl)benzimidazol-5-yl]carbonylamino]-2-(3,4-dimethoxyphenyl)ethanoic acid

Systemtic Name: 2-[[1-cyclohexyl-2-(4-phenylmethoxyphenyl)benzimidazol-5-yl]carbonylamino]-2-(3,4-dimethoxyphenyl)ethanoic acid Openeye Name: 2-[[2-(4-benzyloxyphenyl)-1-cyclohexyl-benzimidazole-5-carbonyl]amino]-2-(3,4-dimethoxyphenyl)acetic acid CAS Name: 2-[[[1-cyclohexyl-2-(4-phenylmethoxyphenyl)-5-benzimidazolyl]-oxomethyl]amino]-2-(3,4-dimethoxyphenyl)acetic acid IUPAC Name: 2-[[1-cyclohexyl-2-(4-phenylmethoxyphenyl)benzimidazole-5-carbonyl]amino]-2-(3,4-dimethoxyphenyl)acetic acid Traditional Name: 2-[[2-(4-benzoxyphenyl)-1-cyclohexyl-benzimidazole-5-carbonyl]amino]-2-(3,4-dimethoxyphenyl)acetic acid Formula: C37H37N3O6 MolecularWeight: 619.70618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C(=O)O)NC(=O)C2=CC3=C(C=C2)N(C(=N3)C4=CC=C(C=C4)OCC5=CC=CC=C5)C6CCCCC6)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C(=O)O)NC(=O)C2=CC3=C(C=C2)N(C(=N3)C4=CC=C(C=C4)OCC5=CC=CC=C5)C6CCCCC6)OC

InChI

InChI=1S/C37H37N3O6/c1-44-32-20-16-26(22-33(32)45-2)34(37(42)43)39-36(41)27-15-19-31-30(21-27)38-35(40(31)28-11-7-4-8-12-28)25-13-17-29(18-14-25)46-23-24-9-5-3-6-10-24/h3,5-6,9-10,13-22,28,34H,4,7-8,11-12,23H2,1-2H3,(H,39,41)(H,42,43)