7,8-bis-(4-methylphenyl)sulfonyloxyoctyl 4-methylbenzenesulfonate

Systemtic Name: 7,8-bis-(4-methylphenyl)sulfonyloxyoctyl 4-methylbenzenesulfonate Openeye Name: 7,8-bis(p-tolylsulfonyloxy)octyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 7,8-bis-(4-methylphenyl)sulfonyloxyoctyl ester IUPAC Name: 7,8-bis-(4-methylphenyl)sulfonyloxyoctyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 7,8-ditosyloxyoctyl ester Formula: C29H36O9S3 MolecularWeight: 624.78574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCC(COS(=O)(=O)C2=CC=C(C=C2)C)OS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCC(COS(=O)(=O)C2=CC=C(C=C2)C)OS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C29H36O9S3/c1-23-9-15-27(16-10-23)39(30,31)36-21-7-5-4-6-8-26(38-41(34,35)29-19-13-25(3)14-20-29)22-37-40(32,33)28-17-11-24(2)12-18-28/h9-20,26H,4-8,21-22H2,1-3H3