diethyl 4-nitro-1H-pyrazole-3,5-dicarboxylate

Systemtic Name: diethyl 4-nitro-1H-pyrazole-3,5-dicarboxylate Openeye Name: diethyl 4-nitro-1H-pyrazole-3,5-dicarboxylate CAS Name: 4-nitro-1H-pyrazole-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-nitro-1H-pyrazole-3,5-dicarboxylate Traditional Name: 4-nitro-1H-pyrazole-3,5-dicarboxylic acid diethyl ester Formula: C9H11N3O6 MolecularWeight: 257.20014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=NN1)C(=O)OCC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C(=NN1)C(=O)OCC)[N+](=O)[O-]

InChI

InChI=1S/C9H11N3O6/c1-3-17-8(13)5-7(12(15)16)6(11-10-5)9(14)18-4-2/h3-4H2,1-2H3,(H,10,11)