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

Systemtic Name: 2-[4-[[5-tert-butyl-3-(cyclohexylmethyl)-2-oxidanylidene-imidazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[5-tert-butyl-3-(cyclohexylmethyl)-2-oxo-imidazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[5-tert-butyl-3-(cyclohexylmethyl)-2-oxo-1-imidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[5-tert-butyl-3-(cyclohexylmethyl)-2-oxoimidazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[5-tert-butyl-3-(cyclohexylmethyl)-2-keto-4-imidazolin-1-yl]methyl]phenyl]benzoic acid Formula: C28H34N2O3 MolecularWeight: 446.58116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CN(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)CC4CCCCC4

Isomeric SMILES

CC(C)(C)C1=CN(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)CC4CCCCC4

InChI

InChI=1S/C28H34N2O3/c1-28(2,3)25-19-29(17-20-9-5-4-6-10-20)27(33)30(25)18-21-13-15-22(16-14-21)23-11-7-8-12-24(23)26(31)32/h7-8,11-16,19-20H,4-6,9-10,17-18H2,1-3H3,(H,31,32)