3-[[5-(3,3-dimethylbutyl)-2-(2-methylphenyl)-1H-imidazol-4-yl]carbonylamino]benzoic acid

Systemtic Name: 3-[[5-(3,3-dimethylbutyl)-2-(2-methylphenyl)-1H-imidazol-4-yl]carbonylamino]benzoic acid Openeye Name: 3-[[5-(3,3-dimethylbutyl)-2-(o-tolyl)-1H-imidazole-4-carbonyl]amino]benzoic acid CAS Name: 3-[[[5-(3,3-dimethylbutyl)-2-(2-methylphenyl)-1H-imidazol-4-yl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[5-(3,3-dimethylbutyl)-2-(2-methylphenyl)-1H-imidazole-4-carbonyl]amino]benzoic acid Traditional Name: 3-[[5-(3,3-dimethylbutyl)-2-(o-tolyl)-1H-imidazole-4-carbonyl]amino]benzoic acid Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC(=C(N2)CCC(C)(C)C)C(=O)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2=NC(=C(N2)CCC(C)(C)C)C(=O)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C24H27N3O3/c1-15-8-5-6-11-18(15)21-26-19(12-13-24(2,3)4)20(27-21)22(28)25-17-10-7-9-16(14-17)23(29)30/h5-11,14H,12-13H2,1-4H3,(H,25,28)(H,26,27)(H,29,30)