[(E)-16-(4-methylphenyl)sulfonyloxyhexadec-8-enyl] 4-methylbenzenesulfonate

Systemtic Name: [(E)-16-(4-methylphenyl)sulfonyloxyhexadec-8-enyl] 4-methylbenzenesulfonate Openeye Name: [(E)-16-(p-tolylsulfonyloxy)hexadec-8-enyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(E)-16-(4-methylphenyl)sulfonyloxyhexadec-8-enyl] ester IUPAC Name: [(E)-16-(4-methylphenyl)sulfonyloxyhexadec-8-enyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(E)-16-tosyloxyhexadec-8-enyl] ester Formula: C30H44O6S2 MolecularWeight: 564.79676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCCC=CCCCCCCCOS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCC/C=C/CCCCCCCOS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C30H44O6S2/c1-27-17-21-29(22-18-27)37(31,32)35-25-15-13-11-9-7-5-3-4-6-8-10-12-14-16-26-36-38(33,34)30-23-19-28(2)20-24-30/h3-4,17-24H,5-16,25-26H2,1-2H3/b4-3+