S-[(2S)-3-bis(chloranyl)phosphoryloxy-2-octanoylsulfanyl-propyl] octanethioate

Systemtic Name: S-[(2S)-3-bis(chloranyl)phosphoryloxy-2-octanoylsulfanyl-propyl] octanethioate Openeye Name: S-[(2S)-3-dichlorophosphoryloxy-2-octanoylsulfanyl-propyl] octanethioate CAS Name: octanethioic acid S-[(2S)-3-dichlorophosphoryloxy-2-(1-oxooctylthio)propyl] ester IUPAC Name: S-[(2S)-3-dichlorophosphoryloxy-2-octanoylsulfanylpropyl] octanethioate Traditional Name: octanethioic acid S-[(2S)-2-(caprylylthio)-3-dichlorophosphoryloxy-propyl] ester Formula: C19H35Cl2O4PS2 MolecularWeight: 493.488561

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)SCC(COP(=O)(Cl)Cl)SC(=O)CCCCCCC

Isomeric SMILES

CCCCCCCC(=O)SC[C@H](COP(=O)(Cl)Cl)SC(=O)CCCCCCC

InChI

InChI=1S/C19H35Cl2O4PS2/c1-3-5-7-9-11-13-18(22)27-16-17(15-25-26(20,21)24)28-19(23)14-12-10-8-6-4-2/h17H,3-16H2,1-2H3/t17-/m0/s1