2-[[4-[bis(fluoranyl)methyl]-3-butyl-2-oxidanylidene-5-propyl-imidazol-1-yl]methyl]-6-phenyl-benzoic acid

Systemtic Name: 2-[[4-[bis(fluoranyl)methyl]-3-butyl-2-oxidanylidene-5-propyl-imidazol-1-yl]methyl]-6-phenyl-benzoic acid Openeye Name: 2-[[3-butyl-4-(difluoromethyl)-2-oxo-5-propyl-imidazol-1-yl]methyl]-6-phenyl-benzoic acid CAS Name: 2-[[3-butyl-4-(difluoromethyl)-2-oxo-5-propyl-1-imidazolyl]methyl]-6-phenylbenzoic acid IUPAC Name: 2-[[3-butyl-4-(difluoromethyl)-2-oxo-5-propylimidazol-1-yl]methyl]-6-phenylbenzoic acid Traditional Name: 2-[[3-butyl-4-(difluoromethyl)-2-keto-5-propyl-4-imidazolin-1-yl]methyl]-6-phenyl-benzoic acid Formula: C25H28F2N2O3 MolecularWeight: 442.498226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N(C1=O)CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3)CCC)C(F)F

Isomeric SMILES

CCCCN1C(=C(N(C1=O)CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3)CCC)C(F)F

InChI

InChI=1S/C25H28F2N2O3/c1-3-5-15-28-22(23(26)27)20(10-4-2)29(25(28)32)16-18-13-9-14-19(21(18)24(30)31)17-11-7-6-8-12-17/h6-9,11-14,23H,3-5,10,15-16H2,1-2H3,(H,30,31)