[acetyloxy-(1-methyl-4-nitro-pyrazol-3-yl)methyl] ethanoate

Systemtic Name: [acetyloxy-(1-methyl-4-nitro-pyrazol-3-yl)methyl] ethanoate Openeye Name: [acetoxy-(1-methyl-4-nitro-pyrazol-3-yl)methyl] acetate CAS Name: acetic acid [acetyloxy-(1-methyl-4-nitro-3-pyrazolyl)methyl] ester IUPAC Name: [acetyloxy-(1-methyl-4-nitropyrazol-3-yl)methyl] acetate Traditional Name: acetic acid [acetoxy-(1-methyl-4-nitro-pyrazol-3-yl)methyl] ester Formula: C9H11N3O6 MolecularWeight: 257.20014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=NN(C=C1[N+](=O)[O-])C)OC(=O)C

Isomeric SMILES

CC(=O)OC(C1=NN(C=C1[N+](=O)[O-])C)OC(=O)C

InChI

InChI=1S/C9H11N3O6/c1-5(13)17-9(18-6(2)14)8-7(12(15)16)4-11(3)10-8/h4,9H,1-3H3