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

Systemtic Name: 3-[[1-cyclohexyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]butanoic acid Openeye Name: 3-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]butanoic acid CAS Name: 3-[[[1-cyclohexyl-2-(3-furanyl)-5-benzimidazolyl]-oxomethyl]amino]butanoic acid IUPAC Name: 3-[[1-cyclohexyl-2-(furan-3-yl)benzimidazole-5-carbonyl]amino]butanoic acid Traditional Name: 3-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]butyric acid Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NC(=O)C1=CC2=C(C=C1)N(C(=N2)C3=COC=C3)C4CCCCC4

Isomeric SMILES

CC(CC(=O)O)NC(=O)C1=CC2=C(C=C1)N(C(=N2)C3=COC=C3)C4CCCCC4

InChI

InChI=1S/C22H25N3O4/c1-14(11-20(26)27)23-22(28)15-7-8-19-18(12-15)24-21(16-9-10-29-13-16)25(19)17-5-3-2-4-6-17/h7-10,12-14,17H,2-6,11H2,1H3,(H,23,28)(H,26,27)