1-methylimidazole-4,5-dicarboxylic acid

Systemtic Name: 1-methylimidazole-4,5-dicarboxylic acid Openeye Name: 1-methylimidazole-4,5-dicarboxylic acid CAS Name: 1-methylimidazole-4,5-dicarboxylic acid IUPAC Name: 1-methylimidazole-4,5-dicarboxylic acid Traditional Name: 1-methylimidazole-4,5-dicarboxylic acid Formula: C6H6N2O4 MolecularWeight: 170.12284

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1C(=O)O)C(=O)O

Isomeric SMILES

CN1C=NC(=C1C(=O)O)C(=O)O

InChI

InChI=1S/C6H6N2O4/c1-8-2-7-3(5(9)10)4(8)6(11)12/h2H,1H3,(H,9,10)(H,11,12)