azanium sodium 4-azanyl-3-nitro-benzenesulfonate

Systemtic Name: azanium sodium 4-azanyl-3-nitro-benzenesulfonate Openeye Name: ammonium sodium 4-amino-3-nitro-benzenesulfonate CAS Name: ammonium sodium 4-amino-3-nitrobenzenesulfonate IUPAC Name: azanium sodium 4-amino-3-nitrobenzenesulfonate Traditional Name: ammonium sodium 4-amino-3-nitro-besylate Formula: C12H14N5NaO10S2 MolecularWeight: 475.38683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C6H6N2O5S.H3N.Na/c2*7-5-2-1-4(14(11,12)13)3-6(5)8(9)10;;/h2*1-3H,7H2,(H,11,12,13);1H3;/q;;;+1/p-1