6-diazonio-2-methyl-3,4-dinitro-phenolate

Systemtic Name: 6-diazonio-2-methyl-3,4-dinitro-phenolate Openeye Name: 6-diazonio-2-methyl-3,4-dinitro-phenolate CAS Name: 6-diazonio-2-methyl-3,4-dinitrophenolate IUPAC Name: 6-diazonio-2-methyl-3,4-dinitrophenolate Traditional Name: 6-diazonio-2-methyl-3,4-dinitro-phenolate Formula: C7H4N4O5 MolecularWeight: 224.13046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1[N+](=O)[O-])[N+](=O)[O-])[N+]#N)[O-]

Isomeric SMILES

CC1=C(C(=CC(=C1[N+](=O)[O-])[N+](=O)[O-])[N+]#N)[O-]

InChI

InChI=1S/C7H4N4O5/c1-3-6(11(15)16)5(10(13)14)2-4(9-8)7(3)12/h2H,1H3