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

Systemtic Name: 2-[4-[[3-cyclohexyl-2-oxidanylidene-5-propyl-4-(trifluoromethyl)imidazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[3-cyclohexyl-2-oxo-5-propyl-4-(trifluoromethyl)imidazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[3-cyclohexyl-2-oxo-5-propyl-4-(trifluoromethyl)-1-imidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[3-cyclohexyl-2-oxo-5-propyl-4-(trifluoromethyl)imidazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[3-cyclohexyl-2-keto-5-propyl-4-(trifluoromethyl)-4-imidazolin-1-yl]methyl]phenyl]benzoic acid Formula: C27H29F3N2O3 MolecularWeight: 486.52597

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C4CCCCC4)C(F)(F)F

Isomeric SMILES

CCCC1=C(N(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C4CCCCC4)C(F)(F)F

InChI

InChI=1S/C27H29F3N2O3/c1-2-8-23-24(27(28,29)30)32(20-9-4-3-5-10-20)26(35)31(23)17-18-13-15-19(16-14-18)21-11-6-7-12-22(21)25(33)34/h6-7,11-16,20H,2-5,8-10,17H2,1H3,(H,33,34)