2-methyl-1,5-dinitro-4-phenyl-pyrazol-3-one

Systemtic Name: 2-methyl-1,5-dinitro-4-phenyl-pyrazol-3-one Openeye Name: 2-methyl-1,5-dinitro-4-phenyl-pyrazol-3-one CAS Name: 2-methyl-1,5-dinitro-4-phenyl-3-pyrazolone IUPAC Name: 2-methyl-1,5-dinitro-4-phenylpyrazol-3-one Traditional Name: 2-methyl-1,5-dinitro-4-phenyl-3-pyrazolin-3-one Formula: C10H8N4O5 MolecularWeight: 264.19432

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N1[N+](=O)[O-])[N+](=O)[O-])C2=CC=CC=C2

Isomeric SMILES

CN1C(=O)C(=C(N1[N+](=O)[O-])[N+](=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C10H8N4O5/c1-11-10(15)8(7-5-3-2-4-6-7)9(13(16)17)12(11)14(18)19/h2-6H,1H3