[3-(4-ethyl-3-methyl-5-oxidanylidene-1H-pyrazol-4-yl)propanoylamino]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: [3-(4-ethyl-3-methyl-5-oxidanylidene-1H-pyrazol-4-yl)propanoylamino]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: [3-(4-ethyl-3-methyl-5-oxo-1H-pyrazol-4-yl)propanoylamino]ammonium; 2-hydroxy-2-oxo-acetate CAS Name: [[3-(4-ethyl-3-methyl-5-oxo-1H-pyrazol-4-yl)-1-oxopropyl]amino]ammonium; 2-hydroxy-2-oxoacetate IUPAC Name: [3-(4-ethyl-3-methyl-5-oxo-1H-pyrazol-4-yl)propanoylamino]azanium; 2-hydroxy-2-oxoacetate Traditional Name: [3-(4-ethyl-3-keto-5-methyl-2-pyrazolin-4-yl)propanoylamino]ammonium binoxalate Formula: C11H18N4O6 MolecularWeight: 302.28382

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=NNC1=O)C)CCC(=O)N[NH3+].C(=O)(C(=O)[O-])O

Isomeric SMILES

CCC1(C(=NNC1=O)C)CCC(=O)N[NH3+].C(=O)(C(=O)[O-])O

InChI

InChI=1S/C9H16N4O2.C2H2O4/c1-3-9(5-4-7(14)11-10)6(2)12-13-8(9)15;3-1(4)2(5)6/h3-5,10H2,1-2H3,(H,11,14)(H,13,15);(H,3,4)(H,5,6)