2-[4-[[3-(cyclohexylmethyl)-4-fluoranyl-2-oxidanylidene-5-propyl-imidazol-1-yl]methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[[3-(cyclohexylmethyl)-4-fluoranyl-2-oxidanylidene-5-propyl-imidazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[3-(cyclohexylmethyl)-4-fluoro-2-oxo-5-propyl-imidazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[3-(cyclohexylmethyl)-4-fluoro-2-oxo-5-propyl-1-imidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[3-(cyclohexylmethyl)-4-fluoro-2-oxo-5-propylimidazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[3-(cyclohexylmethyl)-4-fluoro-2-keto-5-propyl-4-imidazolin-1-yl]methyl]phenyl]benzoic acid Formula: C27H31FN2O3 MolecularWeight: 450.545043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)CC4CCCCC4)F

Isomeric SMILES

CCCC1=C(N(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)CC4CCCCC4)F

InChI

InChI=1S/C27H31FN2O3/c1-2-8-24-25(28)30(18-19-9-4-3-5-10-19)27(33)29(24)17-20-13-15-21(16-14-20)22-11-6-7-12-23(22)26(31)32/h6-7,11-16,19H,2-5,8-10,17-18H2,1H3,(H,31,32)