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

Systemtic Name: 2-[[3-butyl-4-(fluoranylmethyl)-2-oxidanylidene-5-propyl-imidazol-1-yl]methyl]-6-phenyl-benzoic acid Openeye Name: 2-[[3-butyl-4-(fluoromethyl)-2-oxo-5-propyl-imidazol-1-yl]methyl]-6-phenyl-benzoic acid CAS Name: 2-[[3-butyl-4-(fluoromethyl)-2-oxo-5-propyl-1-imidazolyl]methyl]-6-phenylbenzoic acid IUPAC Name: 2-[[3-butyl-4-(fluoromethyl)-2-oxo-5-propylimidazol-1-yl]methyl]-6-phenylbenzoic acid Traditional Name: 2-[[3-butyl-4-(fluoromethyl)-2-keto-5-propyl-4-imidazolin-1-yl]methyl]-6-phenyl-benzoic acid Formula: C25H29FN2O3 MolecularWeight: 424.507763

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)CF

Isomeric SMILES

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

InChI

InChI=1S/C25H29FN2O3/c1-3-5-15-27-22(16-26)21(10-4-2)28(25(27)31)17-19-13-9-14-20(23(19)24(29)30)18-11-7-6-8-12-18/h6-9,11-14H,3-5,10,15-17H2,1-2H3,(H,29,30)