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

Systemtic Name: 2-[(2-butan-2-yl-1-cyclohexyl-benzimidazol-5-yl)carbonylamino]-2-(3,4-dimethoxyphenyl)ethanoic acid Openeye Name: 2-[(1-cyclohexyl-2-sec-butyl-benzimidazole-5-carbonyl)amino]-2-(3,4-dimethoxyphenyl)acetic acid CAS Name: 2-[[(2-butan-2-yl-1-cyclohexyl-5-benzimidazolyl)-oxomethyl]amino]-2-(3,4-dimethoxyphenyl)acetic acid IUPAC Name: 2-[(2-butan-2-yl-1-cyclohexylbenzimidazole-5-carbonyl)amino]-2-(3,4-dimethoxyphenyl)acetic acid Traditional Name: 2-[(1-cyclohexyl-2-sec-butyl-benzimidazole-5-carbonyl)amino]-2-(3,4-dimethoxyphenyl)acetic acid Formula: C28H35N3O5 MolecularWeight: 493.5946

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=NC2=C(N1C3CCCCC3)C=CC(=C2)C(=O)NC(C4=CC(=C(C=C4)OC)OC)C(=O)O

Isomeric SMILES

CCC(C)C1=NC2=C(N1C3CCCCC3)C=CC(=C2)C(=O)NC(C4=CC(=C(C=C4)OC)OC)C(=O)O

InChI

InChI=1S/C28H35N3O5/c1-5-17(2)26-29-21-15-19(11-13-22(21)31(26)20-9-7-6-8-10-20)27(32)30-25(28(33)34)18-12-14-23(35-3)24(16-18)36-4/h11-17,20,25H,5-10H2,1-4H3,(H,30,32)(H,33,34)