methyl 4-(4-methylphenyl)sulfonyloxyoctanoate

Systemtic Name: methyl 4-(4-methylphenyl)sulfonyloxyoctanoate Openeye Name: methyl 4-(p-tolylsulfonyloxy)octanoate CAS Name: 4-(4-methylphenyl)sulfonyloxyoctanoic acid methyl ester IUPAC Name: methyl 4-(4-methylphenyl)sulfonyloxyoctanoate Traditional Name: 4-tosyloxycaprylic acid methyl ester Formula: C16H24O5S MolecularWeight: 328.42376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC(=O)OC)OS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCC(CCC(=O)OC)OS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C16H24O5S/c1-4-5-6-14(9-12-16(17)20-3)21-22(18,19)15-10-7-13(2)8-11-15/h7-8,10-11,14H,4-6,9,12H2,1-3H3