1-[3-(dioxidanyl)-3-methyl-but-1-en-2-yl]sulfinyl-4-methyl-benzene

Systemtic Name: 1-[3-(dioxidanyl)-3-methyl-but-1-en-2-yl]sulfinyl-4-methyl-benzene Openeye Name: 1-(2-hydroperoxy-2-methyl-1-methylene-propyl)sulfinyl-4-methyl-benzene CAS Name: 1-(3-hydroperoxy-3-methylbut-1-en-2-yl)sulfinyl-4-methylbenzene IUPAC Name: 1-(3-hydroperoxy-3-methylbut-1-en-2-yl)sulfinyl-4-methylbenzene Traditional Name: 1-[1-(1-hydroperoxy-1-methyl-ethyl)vinylsulfinyl]-4-methyl-benzene Formula: C12H16O3S MolecularWeight: 240.31864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)C(=C)C(C)(C)OO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)C(=C)C(C)(C)OO

InChI

InChI=1S/C12H16O3S/c1-9-5-7-11(8-6-9)16(14)10(2)12(3,4)15-13/h5-8,13H,2H2,1,3-4H3