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

Systemtic Name: 2-[4-[[5-(3-methylbutyl)-2-oxidanylidene-3-phenyl-imidazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[(5-isopentyl-2-oxo-3-phenyl-imidazol-1-yl)methyl]phenyl]benzoic acid CAS Name: 2-[4-[[5-(3-methylbutyl)-2-oxo-3-phenyl-1-imidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[5-(3-methylbutyl)-2-oxo-3-phenylimidazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[(5-isoamyl-2-keto-3-phenyl-4-imidazolin-1-yl)methyl]phenyl]benzoic acid Formula: C28H28N2O3 MolecularWeight: 440.53352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=CN(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC(C)CCC1=CN(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C28H28N2O3/c1-20(2)12-17-24-19-30(23-8-4-3-5-9-23)28(33)29(24)18-21-13-15-22(16-14-21)25-10-6-7-11-26(25)27(31)32/h3-11,13-16,19-20H,12,17-18H2,1-2H3,(H,31,32)