5-carboxy-1-methyl-imidazole-4-carboxylate

Systemtic Name: 5-carboxy-1-methyl-imidazole-4-carboxylate Openeye Name: 5-carboxy-1-methyl-imidazole-4-carboxylate CAS Name: 5-carboxy-1-methyl-4-imidazolecarboxylate IUPAC Name: 5-carboxy-1-methylimidazole-4-carboxylate Traditional Name: 5-carboxy-1-methyl-imidazole-4-carboxylate Formula: C6H5N2O4- MolecularWeight: 169.1149

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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)/p-1