[2,2-bis(fluoranyl)-3-(4-methylphenyl)sulfonyloxy-propyl] 4-methylbenzenesulfonate

Systemtic Name: [2,2-bis(fluoranyl)-3-(4-methylphenyl)sulfonyloxy-propyl] 4-methylbenzenesulfonate Openeye Name: [2,2-difluoro-3-(p-tolylsulfonyloxy)propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2,2-difluoro-3-(4-methylphenyl)sulfonyloxypropyl] ester IUPAC Name: [2,2-difluoro-3-(4-methylphenyl)sulfonyloxypropyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2,2-difluoro-3-tosyloxy-propyl) ester Formula: C17H18F2O6S2 MolecularWeight: 420.448026

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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)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C17H18F2O6S2/c1-13-3-7-15(8-4-13)26(20,21)24-11-17(18,19)12-25-27(22,23)16-9-5-14(2)6-10-16/h3-10H,11-12H2,1-2H3