6,8-dinitro-2,4-dihydro-[1,2,4]triazolo[3,4-c][1,4]benzoxazin-1-one

Systemtic Name: 6,8-dinitro-2,4-dihydro-[1,2,4]triazolo[3,4-c][1,4]benzoxazin-1-one Openeye Name: 6,8-dinitro-2,4-dihydro-[1,2,4]triazolo[3,4-c][1,4]benzoxazin-1-one CAS Name: 6,8-dinitro-2,4-dihydro-[1,2,4]triazolo[3,4-c][1,4]benzoxazin-1-one IUPAC Name: 6,8-dinitro-2,4-dihydro-[1,2,4]triazolo[3,4-c][1,4]benzoxazin-1-one Traditional Name: 6,8-dinitro-2,4-dihydro-[1,2,4]triazolo[3,4-c][1,4]benzoxazin-1-one Formula: C9H5N5O6 MolecularWeight: 279.1659

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=NNC(=O)N2C3=CC(=CC(=C3O1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1C2=NNC(=O)N2C3=CC(=CC(=C3O1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H5N5O6/c15-9-11-10-7-3-20-8-5(12(7)9)1-4(13(16)17)2-6(8)14(18)19/h1-2H,3H2,(H,11,15)