2-[6-(4-methylphenyl)sulfonylhexylperoxy]benzoic acid

Systemtic Name: 2-[6-(4-methylphenyl)sulfonylhexylperoxy]benzoic acid Openeye Name: 2-[6-(p-tolylsulfonyl)hexylperoxy]benzoic acid CAS Name: 2-[6-(4-methylphenyl)sulfonylhexyldioxy]benzoic acid IUPAC Name: 2-[6-(4-methylphenyl)sulfonylhexylperoxy]benzoic acid Traditional Name: 2-(6-tosylhexylperoxy)benzoic acid Formula: C20H24O6S MolecularWeight: 392.46596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCCCCCOOC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCCCCCOOC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C20H24O6S/c1-16-10-12-17(13-11-16)27(23,24)15-7-3-2-6-14-25-26-19-9-5-4-8-18(19)20(21)22/h4-5,8-13H,2-3,6-7,14-15H2,1H3,(H,21,22)