[(3R)-1-(phenylsulfonyl)tetradecan-3-yl] 4-methylbenzenesulfonate

Systemtic Name: [(3R)-1-(phenylsulfonyl)tetradecan-3-yl] 4-methylbenzenesulfonate Openeye Name: [(1R)-1-[2-(benzenesulfonyl)ethyl]dodecyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(3R)-1-(benzenesulfonyl)tetradecan-3-yl] ester IUPAC Name: [(3R)-1-(benzenesulfonyl)tetradecan-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1R)-1-(2-besylethyl)dodecyl] ester Formula: C27H40O5S2 MolecularWeight: 508.7335

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CCS(=O)(=O)C1=CC=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCCCCCC[C@H](CCS(=O)(=O)C1=CC=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C27H40O5S2/c1-3-4-5-6-7-8-9-10-12-15-25(22-23-33(28,29)26-16-13-11-14-17-26)32-34(30,31)27-20-18-24(2)19-21-27/h11,13-14,16-21,25H,3-10,12,15,22-23H2,1-2H3/t25-/m1/s1