2-[4-[(2-butyl-5-oxidanylidene-4,4-diphenyl-imidazol-1-yl)methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[(2-butyl-5-oxidanylidene-4,4-diphenyl-imidazol-1-yl)methyl]phenyl]benzoic acid Openeye Name: 2-[4-[(2-butyl-5-oxo-4,4-diphenyl-imidazol-1-yl)methyl]phenyl]benzoic acid CAS Name: 2-[4-[(2-butyl-5-oxo-4,4-diphenyl-1-imidazolyl)methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[(2-butyl-5-oxo-4,4-diphenylimidazol-1-yl)methyl]phenyl]benzoic acid Traditional Name: 2-[4-[(2-butyl-5-keto-4,4-diphenyl-2-imidazolin-1-yl)methyl]phenyl]benzoic acid Formula: C33H30N2O3 MolecularWeight: 502.6029

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCCC1=NC(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H30N2O3/c1-2-3-18-30-34-33(26-12-6-4-7-13-26,27-14-8-5-9-15-27)32(38)35(30)23-24-19-21-25(22-20-24)28-16-10-11-17-29(28)31(36)37/h4-17,19-22H,2-3,18,23H2,1H3,(H,36,37)