1,8-dinitro-5H-[1,2,3]triazolo[1,2-a]benzotriazol-10-ium

Systemtic Name: 1,8-dinitro-5H-[1,2,3]triazolo[1,2-a]benzotriazol-10-ium Openeye Name: 1,8-dinitro-5H-triazolo[1,2-a]benzotriazol-10-ium CAS Name: 1,8-dinitro-5H-triazolo[1,2-a]benzotriazol-10-ium IUPAC Name: 1,8-dinitro-5H-triazolo[1,2-a]benzotriazol-10-ium Traditional Name: 1,8-dinitro-5H-triazolo[1,2-a]benzotriazol-10-ium Formula: C8H5N6O4+ MolecularWeight: 249.1631

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])[N+]3=C(C=NN3N2)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])[N+]3=C(C=NN3N2)[N+](=O)[O-]

InChI

InChI=1S/C8H5N6O4/c15-12(16)5-1-2-6-7(3-5)11-8(13(17)18)4-9-14(11)10-6/h1-4H,(H,9,10)/q+1