7-nitro-1,2-dihydrobenzotriazol-4-one

Systemtic Name: 7-nitro-1,2-dihydrobenzotriazol-4-one Openeye Name: 7-nitro-1,2-dihydrobenzotriazol-4-one CAS Name: 7-nitro-1,2-dihydrobenzotriazol-4-one IUPAC Name: 7-nitro-1,2-dihydrobenzotriazol-4-one Traditional Name: 7-nitro-1,2-dihydrobenzotriazol-4-one Formula: C6H4N4O3 MolecularWeight: 180.12096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C2=NNNC2=C1[N+](=O)[O-]

Isomeric SMILES

C1=CC(=O)C2=NNNC2=C1[N+](=O)[O-]

InChI

InChI=1S/C6H4N4O3/c11-4-2-1-3(10(12)13)5-6(4)8-9-7-5/h1-2,7,9H