2-methyl-4-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)benzimidazole-4-carboxylic acid

Systemtic Name: 2-methyl-4-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)benzimidazole-4-carboxylic acid Openeye Name: 4-(4-isopropyl-4-methyl-5-oxo-1H-imidazol-2-yl)-2-methyl-benzimidazole-4-carboxylic acid CAS Name: 2-methyl-4-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-4-benzimidazolecarboxylic acid IUPAC Name: 2-methyl-4-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)benzimidazole-4-carboxylic acid Traditional Name: 4-(4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)-2-methyl-benzimidazole-4-carboxylic acid Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC(C2=N1)(C3=NC(C(=O)N3)(C)C(C)C)C(=O)O

Isomeric SMILES

CC1=NC2=CC=CC(C2=N1)(C3=NC(C(=O)N3)(C)C(C)C)C(=O)O

InChI

InChI=1S/C16H18N4O3/c1-8(2)15(4)13(21)19-12(20-15)16(14(22)23)7-5-6-10-11(16)18-9(3)17-10/h5-8H,1-4H3,(H,22,23)(H,19,20,21)