1-(2-oxidanylidenepropyl)imidazole-4,5-dicarboxylic acid

Systemtic Name: 1-(2-oxidanylidenepropyl)imidazole-4,5-dicarboxylic acid Openeye Name: 1-acetonylimidazole-4,5-dicarboxylic acid CAS Name: 1-(2-oxopropyl)imidazole-4,5-dicarboxylic acid IUPAC Name: 1-(2-oxopropyl)imidazole-4,5-dicarboxylic acid Traditional Name: 1-acetonylimidazole-4,5-dicarboxylic acid Formula: C8H8N2O5 MolecularWeight: 212.15952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H8N2O5/c1-4(11)2-10-3-9-5(7(12)13)6(10)8(14)15/h3H,2H2,1H3,(H,12,13)(H,14,15)