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

Systemtic Name: [2-(4-chlorophenyl)-2-oxidanylidene-ethyl] 4-dodecylbenzenesulfonate Openeye Name: [2-(4-chlorophenyl)-2-oxo-ethyl] 4-dodecylbenzenesulfonate CAS Name: 4-dodecylbenzenesulfonic acid [2-(4-chlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-chlorophenyl)-2-oxoethyl] 4-dodecylbenzenesulfonate Traditional Name: 4-laurylbenzenesulfonic acid [2-(4-chlorophenyl)-2-keto-ethyl] ester Formula: C26H35ClO4S MolecularWeight: 479.0717

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C26H35ClO4S/c1-2-3-4-5-6-7-8-9-10-11-12-22-13-19-25(20-14-22)32(29,30)31-21-26(28)23-15-17-24(27)18-16-23/h13-20H,2-12,21H2,1H3