methyl 4-nitro-1H-pyrazole-5-carboxylate

Systemtic Name: methyl 4-nitro-1H-pyrazole-5-carboxylate Openeye Name: methyl 4-nitro-1H-pyrazole-5-carboxylate CAS Name: 4-nitro-1H-pyrazole-5-carboxylic acid methyl ester IUPAC Name: methyl 4-nitro-1H-pyrazole-5-carboxylate Traditional Name: 4-nitro-1H-pyrazole-5-carboxylic acid methyl ester Formula: C5H5N3O4 MolecularWeight: 171.1109

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H5N3O4/c1-12-5(9)4-3(8(10)11)2-6-7-4/h2H,1H3,(H,6,7)