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

Systemtic Name: 2-[[3,5-dibutyl-4-(fluoranylmethyl)-2-oxidanylidene-imidazol-1-yl]methyl]-6-phenyl-benzoic acid Openeye Name: 2-[[3,5-dibutyl-4-(fluoromethyl)-2-oxo-imidazol-1-yl]methyl]-6-phenyl-benzoic acid CAS Name: 2-[[3,5-dibutyl-4-(fluoromethyl)-2-oxo-1-imidazolyl]methyl]-6-phenylbenzoic acid IUPAC Name: 2-[[3,5-dibutyl-4-(fluoromethyl)-2-oxoimidazol-1-yl]methyl]-6-phenylbenzoic acid Traditional Name: 2-[[3,5-dibutyl-4-(fluoromethyl)-2-keto-4-imidazolin-1-yl]methyl]-6-phenyl-benzoic acid Formula: C26H31FN2O3 MolecularWeight: 438.534343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31FN2O3/c1-3-5-15-22-23(17-27)28(16-6-4-2)26(32)29(22)18-20-13-10-14-21(24(20)25(30)31)19-11-8-7-9-12-19/h7-14H,3-6,15-18H2,1-2H3,(H,30,31)