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

Systemtic Name: [3-(methoxymethoxy)-5-(4-methylphenyl)sulfonyloxy-pentyl] 4-methylbenzenesulfonate Openeye Name: [3-(methoxymethoxy)-5-(p-tolylsulfonyloxy)pentyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3-(methoxymethoxy)-5-(4-methylphenyl)sulfonyloxypentyl] ester IUPAC Name: [3-(methoxymethoxy)-5-(4-methylphenyl)sulfonyloxypentyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [3-(methoxymethoxy)-5-tosyloxy-pentyl] ester Formula: C21H28O8S2 MolecularWeight: 472.57222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28O8S2/c1-17-4-8-20(9-5-17)30(22,23)28-14-12-19(27-16-26-3)13-15-29-31(24,25)21-10-6-18(2)7-11-21/h4-11,19H,12-16H2,1-3H3