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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O4/c1-22(2,21(27)28)24-20(26)14-8-9-18-17(12-14)23-19(15-10-11-29-13-15)25(18)16-6-4-3-5-7-16/h8-13,16H,3-7H2,1-2H3,(H,24,26)(H,27,28)