1-(2-iodanylethylsulfonyl)-2,5-dimethyl-4-(trioxidanylsulfanyl)benzene

Systemtic Name: 1-(2-iodanylethylsulfonyl)-2,5-dimethyl-4-(trioxidanylsulfanyl)benzene Openeye Name: 1-(2-iodoethylsulfonyl)-2,5-dimethyl-4-(trioxidanylsulfanyl)benzene CAS Name: 4-(2-iodoethylsulfonyl)-2,5-dimethylbenzenesulfenic acid hydroperoxy ester IUPAC Name: 1-(2-iodoethylsulfonyl)-2,5-dimethyl-4-(trioxidanylsulfanyl)benzene Traditional Name: 1-(2-iodoethylsulfonyl)-2,5-dimethyl-4-(trioxidanylthio)benzene Formula: C10H13IO5S2 MolecularWeight: 404.24169

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1S(=O)(=O)CCI)C)SOOO

Isomeric SMILES

CC1=CC(=C(C=C1S(=O)(=O)CCI)C)SOOO

InChI

InChI=1S/C10H13IO5S2/c1-7-6-10(18(13,14)4-3-11)8(2)5-9(7)17-16-15-12/h5-6,12H,3-4H2,1-2H3