1-methyl-1,2,4-triazole-3,5-dicarboxylic acid

Systemtic Name: 1-methyl-1,2,4-triazole-3,5-dicarboxylic acid Openeye Name: 1-methyl-1,2,4-triazole-3,5-dicarboxylic acid CAS Name: 1-methyl-1,2,4-triazole-3,5-dicarboxylic acid IUPAC Name: 1-methyl-1,2,4-triazole-3,5-dicarboxylic acid Traditional Name: 1-methyl-1,2,4-triazole-3,5-dicarboxylic acid Formula: C5H5N3O4 MolecularWeight: 171.1109

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)C(=O)O)C(=O)O

Isomeric SMILES

CN1C(=NC(=N1)C(=O)O)C(=O)O

InChI

InChI=1S/C5H5N3O4/c1-8-3(5(11)12)6-2(7-8)4(9)10/h1H3,(H,9,10)(H,11,12)