3,7-dimethyl-4,8-dinitro-1,2-diaza-5-azonia-6-azanidabicyclo[3.3.0]octa-2,4,7-triene

Systemtic Name: 3,7-dimethyl-4,8-dinitro-1,2-diaza-5-azonia-6-azanidabicyclo[3.3.0]octa-2,4,7-triene Openeye Name: 3,7-dimethyl-4,8-dinitro-1,2-diaza-5-azonia-6-azanidabicyclo[3.3.0]octa-2,4,7-triene CAS Name: 3,7-dimethyl-4,8-dinitro-1,2-diaza-5-azonia-6-azanidabicyclo[3.3.0]octa-2,4,7-triene IUPAC Name: 3,7-dimethyl-4,8-dinitro-1,2-diaza-5-azonia-6-azanidabicyclo[3.3.0]octa-2,4,7-triene Traditional Name: 3,7-dimethyl-4,8-dinitro-1,2-diaza-5-azonia-6-azanidabicyclo[3.3.0]octa-2,4,7-triene Formula: C6H6N6O4 MolecularWeight: 226.14964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2N=C(C(=[N+]2[N-]1)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(N2N=C(C(=[N+]2[N-]1)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C6H6N6O4/c1-3-5(11(13)14)9-8-4(2)6(12(15)16)10(9)7-3/h1-2H3