2-(3,4-dinitropyrazol-1-yl)ethanoic acid

Systemtic Name: 2-(3,4-dinitropyrazol-1-yl)ethanoic acid Openeye Name: 2-(3,4-dinitropyrazol-1-yl)acetic acid CAS Name: 2-(3,4-dinitro-1-pyrazolyl)acetic acid IUPAC Name: 2-(3,4-dinitropyrazol-1-yl)acetic acid Traditional Name: 2-(3,4-dinitropyrazol-1-yl)acetic acid Formula: C5H4N4O6 MolecularWeight: 216.10846

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=NN1CC(=O)O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=C(C(=NN1CC(=O)O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C5H4N4O6/c10-4(11)2-7-1-3(8(12)13)5(6-7)9(14)15/h1H,2H2,(H,10,11)