4-[2-[[1-cyclohexyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]-3-oxidanyl-3-oxidanylidene-propyl]-2-fluoranyl-benzoic acid

Systemtic Name: 4-[2-[[1-cyclohexyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]-3-oxidanyl-3-oxidanylidene-propyl]-2-fluoranyl-benzoic acid Openeye Name: 4-[2-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]-3-hydroxy-3-oxo-propyl]-2-fluoro-benzoic acid CAS Name: 4-[2-[[[1-cyclohexyl-2-(3-furanyl)-5-benzimidazolyl]-oxomethyl]amino]-3-hydroxy-3-oxopropyl]-2-fluorobenzoic acid IUPAC Name: 4-[2-[[1-cyclohexyl-2-(furan-3-yl)benzimidazole-5-carbonyl]amino]-3-hydroxy-3-oxopropyl]-2-fluorobenzoic acid Traditional Name: 4-[2-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]-3-hydroxy-3-keto-propyl]-2-fluoro-benzoic acid Formula: C28H26FN3O6 MolecularWeight: 519.520943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H26FN3O6/c29-21-12-16(6-8-20(21)27(34)35)13-23(28(36)37)31-26(33)17-7-9-24-22(14-17)30-25(18-10-11-38-15-18)32(24)19-4-2-1-3-5-19/h6-12,14-15,19,23H,1-5,13H2,(H,31,33)(H,34,35)(H,36,37)