2-[2-(1H-imidazol-5-yl)-2-oxidanylidene-ethyl]propanedioic acid

Systemtic Name: 2-[2-(1H-imidazol-5-yl)-2-oxidanylidene-ethyl]propanedioic acid Openeye Name: 2-[2-(1H-imidazol-5-yl)-2-oxo-ethyl]propanedioic acid CAS Name: 2-[2-(1H-imidazol-5-yl)-2-oxoethyl]propanedioic acid IUPAC Name: 2-[2-(1H-imidazol-5-yl)-2-oxoethyl]propanedioic acid Traditional Name: 2-[2-(1H-imidazol-5-yl)-2-keto-ethyl]malonic acid Formula: C8H8N2O5 MolecularWeight: 212.15952

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)C(=O)CC(C(=O)O)C(=O)O

Isomeric SMILES

C1=C(NC=N1)C(=O)CC(C(=O)O)C(=O)O

InChI

InChI=1S/C8H8N2O5/c11-6(5-2-9-3-10-5)1-4(7(12)13)8(14)15/h2-4H,1H2,(H,9,10)(H,12,13)(H,14,15)