2-(2-methyl-4-nitro-pyrazol-3-yl)ethanoate

Systemtic Name: 2-(2-methyl-4-nitro-pyrazol-3-yl)ethanoate Openeye Name: 2-(2-methyl-4-nitro-pyrazol-3-yl)acetate CAS Name: 2-(2-methyl-4-nitro-3-pyrazolyl)acetate IUPAC Name: 2-(2-methyl-4-nitropyrazol-3-yl)acetate Traditional Name: 2-(2-methyl-4-nitro-pyrazol-3-yl)acetate Formula: C6H6N3O4- MolecularWeight: 184.12954

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)[N+](=O)[O-])CC(=O)[O-]

Isomeric SMILES

CN1C(=C(C=N1)[N+](=O)[O-])CC(=O)[O-]

InChI

InChI=1S/C6H7N3O4/c1-8-4(2-6(10)11)5(3-7-8)9(12)13/h3H,2H2,1H3,(H,10,11)/p-1