azanium 4-azanyl-3-nitro-benzenesulfonate

Systemtic Name: azanium 4-azanyl-3-nitro-benzenesulfonate Openeye Name: ammonium 4-amino-3-nitro-benzenesulfonate CAS Name: ammonium 4-amino-3-nitrobenzenesulfonate IUPAC Name: azanium 4-amino-3-nitrobenzenesulfonate Traditional Name: ammonium 4-amino-3-nitro-besylate Formula: C6H9N3O5S MolecularWeight: 235.21776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)[O-])[N+](=O)[O-])N.[NH4+]

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)[O-])[N+](=O)[O-])N.[NH4+]

InChI

InChI=1S/C6H6N2O5S.H3N/c7-5-2-1-4(14(11,12)13)3-6(5)8(9)10;/h1-3H,7H2,(H,11,12,13);1H3