(E)-1-(4-methoxyphenyl)-4,4-dimethyl-2-methylsulfanylperoxy-3-sulfanyl-pent-2-en-1-one

Systemtic Name: (E)-1-(4-methoxyphenyl)-4,4-dimethyl-2-methylsulfanylperoxy-3-sulfanyl-pent-2-en-1-one Openeye Name: (E)-1-(4-methoxyphenyl)-4,4-dimethyl-2-methylsulfanylperoxy-3-sulfanyl-pent-2-en-1-one CAS Name: methanesulfenic acid [(E)-3-mercapto-1-(4-methoxyphenyl)-4,4-dimethyl-1-oxopent-2-en-2-yl]oxy ester IUPAC Name: (E)-1-(4-methoxyphenyl)-4,4-dimethyl-2-methylsulfanylperoxy-3-sulfanylpent-2-en-1-one Traditional Name: (E)-3-mercapto-1-(4-methoxyphenyl)-4,4-dimethyl-2-(methylthio)peroxy-pent-2-en-1-one Formula: C15H20O4S2 MolecularWeight: 328.4469

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=C(C(=O)C1=CC=C(C=C1)OC)OOSC)S

Isomeric SMILES

CC(C)(C)/C(=C(/C(=O)C1=CC=C(C=C1)OC)\OOSC)/S

InChI

InChI=1S/C15H20O4S2/c1-15(2,3)14(20)13(18-19-21-5)12(16)10-6-8-11(17-4)9-7-10/h6-9,20H,1-5H3/b14-13+