1-azido-3-nitro-benzene diphosphate

Systemtic Name: 1-azido-3-nitro-benzene diphosphate Openeye Name: 1-azido-3-nitro-benzene diphosphate CAS Name: 1-azido-3-nitrobenzene diphosphate IUPAC Name: 1-azido-3-nitrobenzene diphosphate Traditional Name: 1-azido-3-nitro-benzene diphosphate Formula: C6H4N4O10P2-6 MolecularWeight: 354.064282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])N=[N+]=[N-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])N=[N+]=[N-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C6H4N4O2.2H3O4P/c7-9-8-5-2-1-3-6(4-5)10(11)12;2*1-5(2,3)4/h1-4H;2*(H3,1,2,3,4)/p-6