sodium 3-acetamido-5-diazonio-4-oxidanyl-benzenesulfonate

Systemtic Name: sodium 3-acetamido-5-diazonio-4-oxidanyl-benzenesulfonate Openeye Name: sodium 3-acetamido-5-diazonio-4-hydroxy-benzenesulfonate CAS Name: sodium 3-acetamido-5-diazonio-4-hydroxybenzenesulfonate IUPAC Name: sodium 3-acetamido-5-diazonio-4-hydroxybenzenesulfonate Traditional Name: sodium 3-acetamido-5-diazonio-4-hydroxy-besylate Formula: C8H7N3NaO5S+ MolecularWeight: 280.21305

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C(=CC(=C1)S(=O)(=O)[O-])[N+]#N)O.[Na+]

Isomeric SMILES

CC(=O)NC1=C(C(=CC(=C1)S(=O)(=O)[O-])[N+]#N)O.[Na+]

InChI

InChI=1S/C8H7N3O5S.Na/c1-4(12)10-6-2-5(17(14,15)16)3-7(11-9)8(6)13;/h2-3,9H,1H3,(H,14,15,16);/q;+1