[(2R)-1-hexadecoxy-3-(4-methylphenyl)sulfonyloxy-propan-2-yl] hexadecanoate

Systemtic Name: [(2R)-1-hexadecoxy-3-(4-methylphenyl)sulfonyloxy-propan-2-yl] hexadecanoate Openeye Name: [(1R)-1-(hexadecoxymethyl)-2-(p-tolylsulfonyloxy)ethyl] hexadecanoate CAS Name: hexadecanoic acid [(2R)-1-hexadecoxy-3-(4-methylphenyl)sulfonyloxypropan-2-yl] ester IUPAC Name: [(2R)-1-hexadecoxy-3-(4-methylphenyl)sulfonyloxypropan-2-yl] hexadecanoate Traditional Name: palmitic acid [(1R)-1-(cetyloxymethyl)-2-tosyloxy-ethyl] ester Formula: C42H76O6S MolecularWeight: 709.11424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(COS(=O)(=O)C1=CC=C(C=C1)C)OC(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC[C@H](COS(=O)(=O)C1=CC=C(C=C1)C)OC(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C42H76O6S/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-36-46-37-40(38-47-49(44,45)41-34-32-39(3)33-35-41)48-42(43)31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h32-35,40H,4-31,36-38H2,1-3H3/t40-/m1/s1