sodium 3-cyano-4-(methylsulfonylamino)benzenesulfonate

Systemtic Name: sodium 3-cyano-4-(methylsulfonylamino)benzenesulfonate Openeye Name: sodium 3-cyano-4-(methanesulfonamido)benzenesulfonate CAS Name: sodium 3-cyano-4-(methanesulfonamido)benzenesulfonate IUPAC Name: sodium 3-cyano-4-(methanesulfonamido)benzenesulfonate Traditional Name: sodium 3-cyano-4-(methanesulfonamido)besylate Formula: C8H7N2NaO5S2 MolecularWeight: 298.27135

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H8N2O5S2.Na/c1-16(11,12)10-8-3-2-7(17(13,14)15)4-6(8)5-9;/h2-4,10H,1H3,(H,13,14,15);/q;+1/p-1