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

Systemtic Name: 2-[(1-cyclohexyl-2-cyclopropyl-benzimidazol-5-yl)carbonylamino]-2-(3,4-dimethoxyphenyl)ethanoic acid Openeye Name: 2-[(1-cyclohexyl-2-cyclopropyl-benzimidazole-5-carbonyl)amino]-2-(3,4-dimethoxyphenyl)acetic acid CAS Name: 2-[[(1-cyclohexyl-2-cyclopropyl-5-benzimidazolyl)-oxomethyl]amino]-2-(3,4-dimethoxyphenyl)acetic acid IUPAC Name: 2-[(1-cyclohexyl-2-cyclopropylbenzimidazole-5-carbonyl)amino]-2-(3,4-dimethoxyphenyl)acetic acid Traditional Name: 2-[(1-cyclohexyl-2-cyclopropyl-benzimidazole-5-carbonyl)amino]-2-(3,4-dimethoxyphenyl)acetic acid Formula: C27H31N3O5 MolecularWeight: 477.55214

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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)C4CC4)C5CCCCC5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C(=O)O)NC(=O)C2=CC3=C(C=C2)N(C(=N3)C4CC4)C5CCCCC5)OC

InChI

InChI=1S/C27H31N3O5/c1-34-22-13-11-17(15-23(22)35-2)24(27(32)33)29-26(31)18-10-12-21-20(14-18)28-25(16-8-9-16)30(21)19-6-4-3-5-7-19/h10-16,19,24H,3-9H2,1-2H3,(H,29,31)(H,32,33)