2-[4-(4-butan-2-ylphenyl)peroxysulfanyloxy-3,5-dimethyl-phenyl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[4-(4-butan-2-ylphenyl)peroxysulfanyloxy-3,5-dimethyl-phenyl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[3,5-dimethyl-4-(4-sec-butylphenyl)peroxysulfanyloxy-phenyl]-2-oxo-acetic acid CAS Name: 2-[4-[(4-butan-2-ylphenyl)dioxythio]oxy-3,5-dimethylphenyl]-2-oxoacetic acid IUPAC Name: 2-[4-(4-butan-2-ylphenyl)peroxysulfanyloxy-3,5-dimethylphenyl]-2-oxoacetic acid Traditional Name: 2-[3,5-dimethyl-4-[(4-sec-butylphenyl)peroxythio]oxy-phenyl]-2-keto-acetic acid Formula: C20H22O6S MolecularWeight: 390.45008

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OOSOC2=C(C=C(C=C2C)C(=O)C(=O)O)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)OOSOC2=C(C=C(C=C2C)C(=O)C(=O)O)C

InChI

InChI=1S/C20H22O6S/c1-5-12(2)15-6-8-17(9-7-15)24-26-27-25-19-13(3)10-16(11-14(19)4)18(21)20(22)23/h6-12H,5H2,1-4H3,(H,22,23)