sodium 2-iodanylethyl 2,4-dimethyl-5-oxidanidylperoxysulfanyl-benzenesulfonate

Systemtic Name: sodium 2-iodanylethyl 2,4-dimethyl-5-oxidanidylperoxysulfanyl-benzenesulfonate Openeye Name: sodium 2-iodoethyl 2,4-dimethyl-5-oxidoperoxysulfanyl-benzenesulfonate CAS Name: sodium 2,4-dimethyl-5-(oxidodioxythio)benzenesulfonic acid 2-iodoethyl ester IUPAC Name: sodium 2-iodoethyl 2,4-dimethyl-5-oxidoperoxysulfanylbenzenesulfonate Traditional Name: sodium 2,4-dimethyl-5-(oxidoperoxythio)benzenesulfonic acid 2-iodoethyl ester Formula: C10H12INaO6S2 MolecularWeight: 442.22292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1SOO[O-])S(=O)(=O)OCCI)C.[Na+]

Isomeric SMILES

CC1=CC(=C(C=C1SOO[O-])S(=O)(=O)OCCI)C.[Na+]

InChI

InChI=1S/C10H13IO6S2.Na/c1-7-5-8(2)10(6-9(7)18-17-16-12)19(13,14)15-4-3-11;/h5-6,12H,3-4H2,1-2H3;/q;+1/p-1