3-[3-(4-methylphenyl)sulfonyloxypropylsulfanyl]propyl 4-methylbenzenesulfonate

Systemtic Name: 3-[3-(4-methylphenyl)sulfonyloxypropylsulfanyl]propyl 4-methylbenzenesulfonate Openeye Name: 3-[3-(p-tolylsulfonyloxy)propylsulfanyl]propyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-[3-(4-methylphenyl)sulfonyloxypropylthio]propyl ester IUPAC Name: 3-[3-(4-methylphenyl)sulfonyloxypropylsulfanyl]propyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-(3-tosyloxypropylthio)propyl ester Formula: C20H26O6S3 MolecularWeight: 458.61184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCSCCCOS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCSCCCOS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C20H26O6S3/c1-17-5-9-19(10-6-17)28(21,22)25-13-3-15-27-16-4-14-26-29(23,24)20-11-7-18(2)8-12-20/h5-12H,3-4,13-16H2,1-2H3