sodium 3-diazonio-4-oxidanidyl-benzenesulfonate

Systemtic Name: sodium 3-diazonio-4-oxidanidyl-benzenesulfonate Openeye Name: sodium 3-diazonio-4-oxido-benzenesulfonate CAS Name: sodium 3-diazonio-4-oxidobenzenesulfonate IUPAC Name: sodium 3-diazonio-4-oxidobenzenesulfonate Traditional Name: sodium 3-diazonio-4-oxido-besylate Formula: C6H3N2NaO4S MolecularWeight: 222.15379

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H4N2O4S.Na/c7-8-5-3-4(13(10,11)12)1-2-6(5)9;/h1-3H,(H-,9,10,11,12);/q;+1/p-1