dodecyl 1-(4-methylphenyl)ethanesulfonate

Systemtic Name: dodecyl 1-(4-methylphenyl)ethanesulfonate Openeye Name: dodecyl 1-(p-tolyl)ethanesulfonate CAS Name: 1-(4-methylphenyl)ethanesulfonic acid dodecyl ester IUPAC Name: dodecyl 1-(4-methylphenyl)ethanesulfonate Traditional Name: 1-(p-tolyl)ethanesulfonic acid lauryl ester Formula: C21H36O3S MolecularWeight: 368.57374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOS(=O)(=O)C(C)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCCCCCCCCCOS(=O)(=O)C(C)C1=CC=C(C=C1)C

InChI

InChI=1S/C21H36O3S/c1-4-5-6-7-8-9-10-11-12-13-18-24-25(22,23)20(3)21-16-14-19(2)15-17-21/h14-17,20H,4-13,18H2,1-3H3