2-(3-methyl-5-oxidanylidene-1,4-dihydropyrazol-2-ium-4-yl)ethanoate

Systemtic Name: 2-(3-methyl-5-oxidanylidene-1,4-dihydropyrazol-2-ium-4-yl)ethanoate Openeye Name: 2-(3-methyl-5-oxo-1,4-dihydropyrazol-2-ium-4-yl)acetate CAS Name: 2-(3-methyl-5-oxo-1,4-dihydropyrazol-2-ium-4-yl)acetate IUPAC Name: 2-(3-methyl-5-oxo-1,4-dihydropyrazol-2-ium-4-yl)acetate Traditional Name: 2-(3-keto-5-methyl-2-pyrazolin-1-ium-4-yl)acetate Formula: C6H8N2O3 MolecularWeight: 156.13932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]NC(=O)C1CC(=O)[O-]

Isomeric SMILES

CC1=[NH+]NC(=O)C1CC(=O)[O-]

InChI

InChI=1S/C6H8N2O3/c1-3-4(2-5(9)10)6(11)8-7-3/h4H,2H2,1H3,(H,8,11)(H,9,10)