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

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

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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)(C)C4CCCCC4

Isomeric SMILES

CCCCC1=NC(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)(C)C4CCCCC4

InChI

InChI=1S/C28H34N2O3/c1-3-4-14-25-29-28(2,22-10-6-5-7-11-22)27(33)30(25)19-20-15-17-21(18-16-20)23-12-8-9-13-24(23)26(31)32/h8-9,12-13,15-18,22H,3-7,10-11,14,19H2,1-2H3,(H,31,32)