4,6-dinitro-2-(4-nitrophenyl)-1-oxidanidyl-benzotriazol-1-ium

Systemtic Name: 4,6-dinitro-2-(4-nitrophenyl)-1-oxidanidyl-benzotriazol-1-ium Openeye Name: 4,6-dinitro-2-(4-nitrophenyl)-1-oxido-benzotriazol-1-ium CAS Name: 4,6-dinitro-2-(4-nitrophenyl)-1-oxidobenzotriazol-1-ium IUPAC Name: 4,6-dinitro-2-(4-nitrophenyl)-1-oxidobenzotriazol-1-ium Traditional Name: 4,6-dinitro-2-(4-nitrophenyl)-1-oxido-benzotriazol-1-ium Formula: C12H6N6O7 MolecularWeight: 346.21204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2N=C3C(=CC(=CC3=[N+]2[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1N2N=C3C(=CC(=CC3=[N+]2[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H6N6O7/c19-15-10-5-9(17(22)23)6-11(18(24)25)12(10)13-14(15)7-1-3-8(4-2-7)16(20)21/h1-6H