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

Systemtic Name: 2-[4-[(5-butyl-4-fluoranyl-2-oxidanylidene-3-propan-2-yl-imidazol-1-yl)methyl]phenyl]benzoic acid Openeye Name: 2-[4-[(5-butyl-4-fluoro-3-isopropyl-2-oxo-imidazol-1-yl)methyl]phenyl]benzoic acid CAS Name: 2-[4-[(5-butyl-4-fluoro-2-oxo-3-propan-2-yl-1-imidazolyl)methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[(5-butyl-4-fluoro-2-oxo-3-propan-2-ylimidazol-1-yl)methyl]phenyl]benzoic acid Traditional Name: 2-[4-[(5-butyl-4-fluoro-3-isopropyl-2-keto-4-imidazolin-1-yl)methyl]phenyl]benzoic acid Formula: C24H27FN2O3 MolecularWeight: 410.481183

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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)C)F

Isomeric SMILES

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

InChI

InChI=1S/C24H27FN2O3/c1-4-5-10-21-22(25)27(16(2)3)24(30)26(21)15-17-11-13-18(14-12-17)19-8-6-7-9-20(19)23(28)29/h6-9,11-14,16H,4-5,10,15H2,1-3H3,(H,28,29)