1,3-dimethyl-5-(trioxidanylsulfanyl)-2-[tris(bromanyl)methylsulfonyl]benzene

Systemtic Name: 1,3-dimethyl-5-(trioxidanylsulfanyl)-2-[tris(bromanyl)methylsulfonyl]benzene Openeye Name: 1,3-dimethyl-2-(tribromomethylsulfonyl)-5-(trioxidanylsulfanyl)benzene CAS Name: 3,5-dimethyl-4-(tribromomethylsulfonyl)benzenesulfenic acid hydroperoxy ester IUPAC Name: 1,3-dimethyl-2-(tribromomethylsulfonyl)-5-(trioxidanylsulfanyl)benzene Traditional Name: 1,3-dimethyl-2-(tribromomethylsulfonyl)-5-(trioxidanylthio)benzene Formula: C9H9Br3O5S2 MolecularWeight: 501.00676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9Br3O5S2/c1-5-3-7(18-17-16-13)4-6(2)8(5)19(14,15)9(10,11)12/h3-4,13H,1-2H3