[2-(4-methylphenyl)-2-oxidanylidene-ethyl] 4-dodecylbenzenesulfonate

Systemtic Name: [2-(4-methylphenyl)-2-oxidanylidene-ethyl] 4-dodecylbenzenesulfonate Openeye Name: [2-oxo-2-(p-tolyl)ethyl] 4-dodecylbenzenesulfonate CAS Name: 4-dodecylbenzenesulfonic acid [2-(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylphenyl)-2-oxoethyl] 4-dodecylbenzenesulfonate Traditional Name: 4-laurylbenzenesulfonic acid [2-keto-2-(p-tolyl)ethyl] ester Formula: C27H38O4S MolecularWeight: 458.65322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)OCC(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)OCC(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C27H38O4S/c1-3-4-5-6-7-8-9-10-11-12-13-24-16-20-26(21-17-24)32(29,30)31-22-27(28)25-18-14-23(2)15-19-25/h14-21H,3-13,22H2,1-2H3