6,8-dinitro-2H-pyrrolo[1,2-d][1,2,4]triazin-1-one

Systemtic Name: 6,8-dinitro-2H-pyrrolo[1,2-d][1,2,4]triazin-1-one Openeye Name: 6,8-dinitro-2H-pyrrolo[1,2-d][1,2,4]triazin-1-one CAS Name: 6,8-dinitro-2H-pyrrolo[1,2-d][1,2,4]triazin-1-one IUPAC Name: 6,8-dinitro-2H-pyrrolo[1,2-d][1,2,4]triazin-1-one Traditional Name: 6,8-dinitro-2H-pyrrolo[1,2-d][1,2,4]triazin-1-one Formula: C6H3N5O5 MolecularWeight: 225.11852

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N2C=NNC(=O)C2=C1[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=C(N2C=NNC(=O)C2=C1[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C6H3N5O5/c12-6-5-3(10(13)14)1-4(11(15)16)9(5)2-7-8-6/h1-2H,(H,8,12)