4-azanyl-3,5-dinitro-benzoate

Systemtic Name: 4-azanyl-3,5-dinitro-benzoate Openeye Name: 4-amino-3,5-dinitro-benzoate CAS Name: 4-amino-3,5-dinitrobenzoate IUPAC Name: 4-amino-3,5-dinitrobenzoate Traditional Name: 4-amino-3,5-dinitro-benzoate Formula: C7H4N3O6- MolecularWeight: 226.12316

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])N)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])N)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C7H5N3O6/c8-6-4(9(13)14)1-3(7(11)12)2-5(6)10(15)16/h1-2H,8H2,(H,11,12)/p-1