S-[(2S)-3-bis(chloranyl)phosphoryloxy-2-nonanoylsulfanyl-propyl] nonanethioate

Systemtic Name: S-[(2S)-3-bis(chloranyl)phosphoryloxy-2-nonanoylsulfanyl-propyl] nonanethioate Openeye Name: S-[(2S)-3-dichlorophosphoryloxy-2-nonanoylsulfanyl-propyl] nonanethioate CAS Name: nonanethioic acid S-[(2S)-3-dichlorophosphoryloxy-2-(1-oxononylthio)propyl] ester IUPAC Name: S-[(2S)-3-dichlorophosphoryloxy-2-nonanoylsulfanylpropyl] nonanethioate Traditional Name: nonanethioic acid S-[(2S)-3-dichlorophosphoryloxy-2-(pelargonylthio)propyl] ester Formula: C21H39Cl2O4PS2 MolecularWeight: 521.541721

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H39Cl2O4PS2/c1-3-5-7-9-11-13-15-20(24)29-18-19(17-27-28(22,23)26)30-21(25)16-14-12-10-8-6-4-2/h19H,3-18H2,1-2H3/t19-/m0/s1