2-methyl-6-oxidanylidene-7-(2,4,6-trimethylphenyl)-5H-imidazo[1,2-a]imidazole-3-carboxylic acid

Systemtic Name: 2-methyl-6-oxidanylidene-7-(2,4,6-trimethylphenyl)-5H-imidazo[1,2-a]imidazole-3-carboxylic acid Openeye Name: 2-methyl-6-oxo-7-(2,4,6-trimethylphenyl)-5H-imidazo[1,2-a]imidazole-3-carboxylic acid CAS Name: 2-methyl-6-oxo-7-(2,4,6-trimethylphenyl)-5H-imidazo[1,2-a]imidazole-3-carboxylic acid IUPAC Name: 2-methyl-6-oxo-7-(2,4,6-trimethylphenyl)-5H-imidazo[1,2-a]imidazole-3-carboxylic acid Traditional Name: 6-keto-7-mesityl-2-methyl-5H-imidaz[1,2-a]imidazole-3-carboxylic acid Formula: C16H17N3O3 MolecularWeight: 299.32448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N2C(=O)CN3C2=NC(=C3C(=O)O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N2C(=O)CN3C2=NC(=C3C(=O)O)C)C

InChI

InChI=1S/C16H17N3O3/c1-8-5-9(2)13(10(3)6-8)19-12(20)7-18-14(15(21)22)11(4)17-16(18)19/h5-6H,7H2,1-4H3,(H,21,22)