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

Systemtic Name: 2-[[1-cyclohexyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]-2-(3,4-diethoxyphenyl)ethanoic acid Openeye Name: 2-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]-2-(3,4-diethoxyphenyl)acetic acid CAS Name: 2-[[[1-cyclohexyl-2-(3-furanyl)-5-benzimidazolyl]-oxomethyl]amino]-2-(3,4-diethoxyphenyl)acetic acid IUPAC Name: 2-[[1-cyclohexyl-2-(furan-3-yl)benzimidazole-5-carbonyl]amino]-2-(3,4-diethoxyphenyl)acetic acid Traditional Name: 2-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]-2-(3,4-diethoxyphenyl)acetic acid Formula: C30H33N3O6 MolecularWeight: 531.59952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C(=O)O)NC(=O)C2=CC3=C(C=C2)N(C(=N3)C4=COC=C4)C5CCCCC5)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C(=O)O)NC(=O)C2=CC3=C(C=C2)N(C(=N3)C4=COC=C4)C5CCCCC5)OCC

InChI

InChI=1S/C30H33N3O6/c1-3-38-25-13-11-19(17-26(25)39-4-2)27(30(35)36)32-29(34)20-10-12-24-23(16-20)31-28(21-14-15-37-18-21)33(24)22-8-6-5-7-9-22/h10-18,22,27H,3-9H2,1-2H3,(H,32,34)(H,35,36)