[2-cyclobutyl-3-(4-methylphenyl)sulfonyloxy-propyl] 4-methylbenzenesulfonate

Systemtic Name: [2-cyclobutyl-3-(4-methylphenyl)sulfonyloxy-propyl] 4-methylbenzenesulfonate Openeye Name: [2-cyclobutyl-3-(p-tolylsulfonyloxy)propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-cyclobutyl-3-(4-methylphenyl)sulfonyloxypropyl] ester IUPAC Name: [2-cyclobutyl-3-(4-methylphenyl)sulfonyloxypropyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-cyclobutyl-3-tosyloxy-propyl) ester Formula: C21H26O6S2 MolecularWeight: 438.55754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(COS(=O)(=O)C2=CC=C(C=C2)C)C3CCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(COS(=O)(=O)C2=CC=C(C=C2)C)C3CCC3

InChI

InChI=1S/C21H26O6S2/c1-16-6-10-20(11-7-16)28(22,23)26-14-19(18-4-3-5-18)15-27-29(24,25)21-12-8-17(2)9-13-21/h6-13,18-19H,3-5,14-15H2,1-2H3