sodium 2-iodanylethyl 4-methyl-3-oxidanidylperoxysulfanyl-benzenesulfonate

Systemtic Name: sodium 2-iodanylethyl 4-methyl-3-oxidanidylperoxysulfanyl-benzenesulfonate Openeye Name: sodium 2-iodoethyl 4-methyl-3-oxidoperoxysulfanyl-benzenesulfonate CAS Name: sodium 4-methyl-3-(oxidodioxythio)benzenesulfonic acid 2-iodoethyl ester IUPAC Name: sodium 2-iodoethyl 4-methyl-3-oxidoperoxysulfanylbenzenesulfonate Traditional Name: sodium 4-methyl-3-(oxidoperoxythio)benzenesulfonic acid 2-iodoethyl ester Formula: C9H10INaO6S2 MolecularWeight: 428.19634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)OCCI)SOO[O-].[Na+]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)OCCI)SOO[O-].[Na+]

InChI

InChI=1S/C9H11IO6S2.Na/c1-7-2-3-8(6-9(7)17-16-15-11)18(12,13)14-5-4-10;/h2-3,6,11H,4-5H2,1H3;/q;+1/p-1