trisodium 3-(methylsulfonylamino)-5-oxidanidylperoxysulfanyl-naphthalene-2,7-disulfonate

Systemtic Name: trisodium 3-(methylsulfonylamino)-5-oxidanidylperoxysulfanyl-naphthalene-2,7-disulfonate Openeye Name: trisodium 3-(methanesulfonamido)-5-oxidoperoxysulfanyl-naphthalene-2,7-disulfonate CAS Name: trisodium 3-(methanesulfonamido)-5-(oxidodioxythio)naphthalene-2,7-disulfonate IUPAC Name: trisodium 3-(methanesulfonamido)-5-oxidoperoxysulfanylnaphthalene-2,7-disulfonate Traditional Name: trisodium 3-(methanesulfonamido)-5-(oxidoperoxythio)naphthalene-2,7-disulfonate Formula: C11H8NNa3O11S4 MolecularWeight: 527.41063

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=C(C=C2C=C(C=C(C2=C1)SOO[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

CS(=O)(=O)NC1=C(C=C2C=C(C=C(C2=C1)SOO[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C11H11NO11S4.3Na/c1-25(14,15)12-9-5-8-6(3-11(9)27(19,20)21)2-7(26(16,17)18)4-10(8)24-23-22-13;;;/h2-5,12-13H,1H3,(H,16,17,18)(H,19,20,21);;;/q;3*+1/p-3