5-(2-iodanylethylsulfonyl)-4-methyl-2-(trioxidanylsulfanyl)phenol

Systemtic Name: 5-(2-iodanylethylsulfonyl)-4-methyl-2-(trioxidanylsulfanyl)phenol Openeye Name: 5-(2-iodoethylsulfonyl)-4-methyl-2-(trioxidanylsulfanyl)phenol CAS Name: 2-hydroxy-4-(2-iodoethylsulfonyl)-5-methylbenzenesulfenic acid hydroperoxy ester IUPAC Name: 5-(2-iodoethylsulfonyl)-4-methyl-2-(trioxidanylsulfanyl)phenol Traditional Name: 5-(2-iodoethylsulfonyl)-4-methyl-2-(trioxidanylthio)phenol Formula: C9H11IO6S2 MolecularWeight: 406.21451

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11IO6S2/c1-6-4-8(17-16-15-12)7(11)5-9(6)18(13,14)3-2-10/h4-5,11-12H,2-3H2,1H3