1-(3,4-dinitropyrazol-1-yl)propan-2-one

Systemtic Name: 1-(3,4-dinitropyrazol-1-yl)propan-2-one Openeye Name: 1-(3,4-dinitropyrazol-1-yl)propan-2-one CAS Name: 1-(3,4-dinitro-1-pyrazolyl)-2-propanone IUPAC Name: 1-(3,4-dinitropyrazol-1-yl)propan-2-one Traditional Name: 1-(3,4-dinitropyrazol-1-yl)acetone Formula: C6H6N4O5 MolecularWeight: 214.13564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H6N4O5/c1-4(11)2-8-3-5(9(12)13)6(7-8)10(14)15/h3H,2H2,1H3