4-azanyl-3,5-dinitro-benzenesulfonate

Systemtic Name: 4-azanyl-3,5-dinitro-benzenesulfonate Openeye Name: 4-amino-3,5-dinitro-benzenesulfonate CAS Name: 4-amino-3,5-dinitrobenzenesulfonate IUPAC Name: 4-amino-3,5-dinitrobenzenesulfonate Traditional Name: 4-amino-3,5-dinitro-besylate Formula: C6H4N3O7S- MolecularWeight: 262.17686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H5N3O7S/c7-6-4(8(10)11)1-3(17(14,15)16)2-5(6)9(12)13/h1-2H,7H2,(H,14,15,16)/p-1