4-[(1,4-dimethylpyrrol-2-yl)carbonylamino]-1-methyl-imidazole-2-carboxylic acid

Systemtic Name: 4-[(1,4-dimethylpyrrol-2-yl)carbonylamino]-1-methyl-imidazole-2-carboxylic acid Openeye Name: 4-[(1,4-dimethylpyrrole-2-carbonyl)amino]-1-methyl-imidazole-2-carboxylic acid CAS Name: 4-[[(1,4-dimethyl-2-pyrrolyl)-oxomethyl]amino]-1-methyl-2-imidazolecarboxylic acid IUPAC Name: 4-[(1,4-dimethylpyrrole-2-carbonyl)amino]-1-methylimidazole-2-carboxylic acid Traditional Name: 4-[(1,4-dimethylpyrrole-2-carbonyl)amino]-1-methyl-imidazole-2-carboxylic acid Formula: C12H14N4O3 MolecularWeight: 262.26456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=C1)C(=O)NC2=CN(C(=N2)C(=O)O)C)C

Isomeric SMILES

CC1=CN(C(=C1)C(=O)NC2=CN(C(=N2)C(=O)O)C)C

InChI

InChI=1S/C12H14N4O3/c1-7-4-8(15(2)5-7)11(17)14-9-6-16(3)10(13-9)12(18)19/h4-6H,1-3H3,(H,14,17)(H,18,19)