octyl 2,4-bis-(4-methylphenyl)sulfonyloxybutanoate

Systemtic Name: octyl 2,4-bis-(4-methylphenyl)sulfonyloxybutanoate Openeye Name: octyl 2,4-bis(p-tolylsulfonyloxy)butanoate CAS Name: 2,4-bis-(4-methylphenyl)sulfonyloxybutanoic acid octyl ester IUPAC Name: octyl 2,4-bis-(4-methylphenyl)sulfonyloxybutanoate Traditional Name: 2,4-ditosyloxybutyric acid octyl ester Formula: C26H36O8S2 MolecularWeight: 540.68924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C(CCOS(=O)(=O)C1=CC=C(C=C1)C)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCCCOC(=O)C(CCOS(=O)(=O)C1=CC=C(C=C1)C)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C26H36O8S2/c1-4-5-6-7-8-9-19-32-26(27)25(34-36(30,31)24-16-12-22(3)13-17-24)18-20-33-35(28,29)23-14-10-21(2)11-15-23/h10-17,25H,4-9,18-20H2,1-3H3