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

Systemtic Name: 3-[[2-(2-methylphenyl)-5-phenethyl-1H-imidazol-4-yl]carbonylamino]benzoic acid Openeye Name: 3-[[2-(o-tolyl)-5-phenethyl-1H-imidazole-4-carbonyl]amino]benzoic acid CAS Name: 3-[[[2-(2-methylphenyl)-5-phenethyl-1H-imidazol-4-yl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[2-(2-methylphenyl)-5-phenethyl-1H-imidazole-4-carbonyl]amino]benzoic acid Traditional Name: 3-[[2-(o-tolyl)-5-phenethyl-1H-imidazole-4-carbonyl]amino]benzoic acid Formula: C26H23N3O3 MolecularWeight: 425.47912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC(=C(N2)CCC3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2=NC(=C(N2)CCC3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C26H23N3O3/c1-17-8-5-6-13-21(17)24-28-22(15-14-18-9-3-2-4-10-18)23(29-24)25(30)27-20-12-7-11-19(16-20)26(31)32/h2-13,16H,14-15H2,1H3,(H,27,30)(H,28,29)(H,31,32)