S-[(2R)-1-dimethoxyphosphoryloxy-3-octoxy-propan-2-yl] octanethioate

Systemtic Name: S-[(2R)-1-dimethoxyphosphoryloxy-3-octoxy-propan-2-yl] octanethioate Openeye Name: S-[(1R)-1-(dimethoxyphosphoryloxymethyl)-2-octoxy-ethyl] octanethioate CAS Name: octanethioic acid S-[(2R)-1-dimethoxyphosphoryloxy-3-octoxypropan-2-yl] ester IUPAC Name: S-[(2R)-1-dimethoxyphosphoryloxy-3-octoxypropan-2-yl] octanethioate Traditional Name: octanethioic acid S-[(1R)-1-(dimethoxyphosphoryloxymethyl)-2-octoxy-ethyl] ester Formula: C21H43O6PS MolecularWeight: 454.601281

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOCC(COP(=O)(OC)OC)SC(=O)CCCCCCC

Isomeric SMILES

CCCCCCCCOC[C@H](COP(=O)(OC)OC)SC(=O)CCCCCCC

InChI

InChI=1S/C21H43O6PS/c1-5-7-9-11-13-15-17-26-18-20(19-27-28(23,24-3)25-4)29-21(22)16-14-12-10-8-6-2/h20H,5-19H2,1-4H3/t20-/m1/s1