3-[[1-cyclohexyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]-4-(4-hydroxyphenyl)butanoic acid

Systemtic Name: 3-[[1-cyclohexyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]-4-(4-hydroxyphenyl)butanoic acid Openeye Name: 3-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]-4-(4-hydroxyphenyl)butanoic acid CAS Name: 3-[[[1-cyclohexyl-2-(3-furanyl)-5-benzimidazolyl]-oxomethyl]amino]-4-(4-hydroxyphenyl)butanoic acid IUPAC Name: 3-[[1-cyclohexyl-2-(furan-3-yl)benzimidazole-5-carbonyl]amino]-4-(4-hydroxyphenyl)butanoic acid Traditional Name: 3-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]-4-(4-hydroxyphenyl)butyric acid Formula: C28H29N3O5 MolecularWeight: 487.54696

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)NC(CC4=CC=C(C=C4)O)CC(=O)O)N=C2C5=COC=C5

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)NC(CC4=CC=C(C=C4)O)CC(=O)O)N=C2C5=COC=C5

InChI

InChI=1S/C28H29N3O5/c32-23-9-6-18(7-10-23)14-21(16-26(33)34)29-28(35)19-8-11-25-24(15-19)30-27(20-12-13-36-17-20)31(25)22-4-2-1-3-5-22/h6-13,15,17,21-22,32H,1-5,14,16H2,(H,29,35)(H,33,34)