4-(2-iodanylethylsulfonyl)-2-methyl-1-(trioxidanylsulfanyl)benzene

Systemtic Name: 4-(2-iodanylethylsulfonyl)-2-methyl-1-(trioxidanylsulfanyl)benzene Openeye Name: 4-(2-iodoethylsulfonyl)-2-methyl-1-(trioxidanylsulfanyl)benzene CAS Name: 4-(2-iodoethylsulfonyl)-2-methylbenzenesulfenic acid hydroperoxy ester IUPAC Name: 4-(2-iodoethylsulfonyl)-2-methyl-1-(trioxidanylsulfanyl)benzene Traditional Name: 4-(2-iodoethylsulfonyl)-2-methyl-1-(trioxidanylthio)benzene Formula: C9H11IO5S2 MolecularWeight: 390.21511

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)CCI)SOOO

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)CCI)SOOO

InChI

InChI=1S/C9H11IO5S2/c1-7-6-8(17(12,13)5-4-10)2-3-9(7)16-15-14-11/h2-3,6,11H,4-5H2,1H3