2,3-bis-(4-methylphenyl)sulfonyloxyheptyl 4-methylbenzenesulfonate

Systemtic Name: 2,3-bis-(4-methylphenyl)sulfonyloxyheptyl 4-methylbenzenesulfonate Openeye Name: 2,3-bis(p-tolylsulfonyloxy)heptyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2,3-bis-(4-methylphenyl)sulfonyloxyheptyl ester IUPAC Name: 2,3-bis-(4-methylphenyl)sulfonyloxyheptyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2,3-ditosyloxyheptyl ester Formula: C28H34O9S3 MolecularWeight: 610.75916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(COS(=O)(=O)C1=CC=C(C=C1)C)OS(=O)(=O)C2=CC=C(C=C2)C)OS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCC(C(COS(=O)(=O)C1=CC=C(C=C1)C)OS(=O)(=O)C2=CC=C(C=C2)C)OS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C28H34O9S3/c1-5-6-7-27(36-39(31,32)25-16-10-22(3)11-17-25)28(37-40(33,34)26-18-12-23(4)13-19-26)20-35-38(29,30)24-14-8-21(2)9-15-24/h8-19,27-28H,5-7,20H2,1-4H3