2-[[3,5-dibutyl-2-oxidanylidene-4-(trifluoromethyl)imidazol-1-yl]methyl]-6-phenyl-benzoic acid

Systemtic Name: 2-[[3,5-dibutyl-2-oxidanylidene-4-(trifluoromethyl)imidazol-1-yl]methyl]-6-phenyl-benzoic acid Openeye Name: 2-[[3,5-dibutyl-2-oxo-4-(trifluoromethyl)imidazol-1-yl]methyl]-6-phenyl-benzoic acid CAS Name: 2-[[3,5-dibutyl-2-oxo-4-(trifluoromethyl)-1-imidazolyl]methyl]-6-phenylbenzoic acid IUPAC Name: 2-[[3,5-dibutyl-2-oxo-4-(trifluoromethyl)imidazol-1-yl]methyl]-6-phenylbenzoic acid Traditional Name: 2-[[3,5-dibutyl-2-keto-4-(trifluoromethyl)-4-imidazolin-1-yl]methyl]-6-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=CC(=C2C(=O)O)C3=CC=CC=C3)CCCC)C(F)(F)F

Isomeric SMILES

CCCCC1=C(N(C(=O)N1CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3)CCCC)C(F)(F)F

InChI

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