1,1-dimethyl-4-nitro-benzotriazol-1-ium

Systemtic Name: 1,1-dimethyl-4-nitro-benzotriazol-1-ium Openeye Name: 1,1-dimethyl-4-nitro-benzotriazol-1-ium CAS Name: 1,1-dimethyl-4-nitrobenzotriazol-1-ium IUPAC Name: 1,1-dimethyl-4-nitrobenzotriazol-1-ium Traditional Name: 1,1-dimethyl-4-nitro-benzotriazol-1-ium Formula: C8H9N4O2+ MolecularWeight: 193.18266

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C2=CC=CC(=C2N=N1)[N+](=O)[O-])C

Isomeric SMILES

C[N+]1(C2=CC=CC(=C2N=N1)[N+](=O)[O-])C

InChI

InChI=1S/C8H9N4O2/c1-12(2)7-5-3-4-6(11(13)14)8(7)9-10-12/h3-5H,1-2H3/q+1