[3,3-dimethyl-5-(4-methylphenyl)sulfonyloxy-pentyl] 4-methylbenzenesulfonate

Systemtic Name: [3,3-dimethyl-5-(4-methylphenyl)sulfonyloxy-pentyl] 4-methylbenzenesulfonate Openeye Name: [3,3-dimethyl-5-(p-tolylsulfonyloxy)pentyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3,3-dimethyl-5-(4-methylphenyl)sulfonyloxypentyl] ester IUPAC Name: [3,3-dimethyl-5-(4-methylphenyl)sulfonyloxypentyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (3,3-dimethyl-5-tosyloxy-pentyl) ester Formula: C21H28O6S2 MolecularWeight: 440.57342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C)(C)CCOS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C)(C)CCOS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H28O6S2/c1-17-5-9-19(10-6-17)28(22,23)26-15-13-21(3,4)14-16-27-29(24,25)20-11-7-18(2)8-12-20/h5-12H,13-16H2,1-4H3