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

Systemtic Name: 2-[4-[[3-butan-2-yl-5-butyl-2-oxidanylidene-4-(trifluoromethyl)imidazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[5-butyl-2-oxo-3-sec-butyl-4-(trifluoromethyl)imidazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[3-butan-2-yl-5-butyl-2-oxo-4-(trifluoromethyl)-1-imidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[3-butan-2-yl-5-butyl-2-oxo-4-(trifluoromethyl)imidazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[5-butyl-2-keto-3-sec-butyl-4-(trifluoromethyl)-4-imidazolin-1-yl]methyl]phenyl]benzoic acid Formula: C26H29F3N2O3 MolecularWeight: 474.51527

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C(C)CC)C(F)(F)F

Isomeric SMILES

CCCCC1=C(N(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C(C)CC)C(F)(F)F

InChI

InChI=1S/C26H29F3N2O3/c1-4-6-11-22-23(26(27,28)29)31(17(3)5-2)25(34)30(22)16-18-12-14-19(15-13-18)20-9-7-8-10-21(20)24(32)33/h7-10,12-15,17H,4-6,11,16H2,1-3H3,(H,32,33)