[(2S)-2-decanoyloxy-3-decanoylsulfanyl-propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [(2S)-2-decanoyloxy-3-decanoylsulfanyl-propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [(2S)-2-decanoyloxy-3-decanoylsulfanyl-propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [(2S)-2-(1-oxodecoxy)-3-(1-oxodecylthio)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [(2S)-2-decanoyloxy-3-decanoylsulfanylpropyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [(2S)-2-capryloxy-3-(caprylthio)propyl] 2-(trimethylammonio)ethyl phosphate Formula: C28H56NO7PS MolecularWeight: 581.785501

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OC(COP(=O)([O-])OCC[N+](C)(C)C)CSC(=O)CCCCCCCCC

Isomeric SMILES

CCCCCCCCCC(=O)O[C@@H](COP(=O)([O-])OCC[N+](C)(C)C)CSC(=O)CCCCCCCCC

InChI

InChI=1S/C28H56NO7PS/c1-6-8-10-12-14-16-18-20-27(30)36-26(24-35-37(32,33)34-23-22-29(3,4)5)25-38-28(31)21-19-17-15-13-11-9-7-2/h26H,6-25H2,1-5H3/t26-/m0/s1