7,7-dinitro-5,6-dihydro-2H-benzotriazol-4-one

Systemtic Name: 7,7-dinitro-5,6-dihydro-2H-benzotriazol-4-one Openeye Name: 7,7-dinitro-5,6-dihydro-2H-benzotriazol-4-one CAS Name: 7,7-dinitro-5,6-dihydro-2H-benzotriazol-4-one IUPAC Name: 7,7-dinitro-5,6-dihydro-2H-benzotriazol-4-one Traditional Name: 7,7-dinitro-5,6-dihydro-2H-benzotriazol-4-one Formula: C6H5N5O5 MolecularWeight: 227.1344

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=NNN=C2C1=O)([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CC(C2=NNN=C2C1=O)([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C6H5N5O5/c12-3-1-2-6(10(13)14,11(15)16)5-4(3)7-9-8-5/h1-2H2,(H,7,8,9)