2-[2,3-bis(16-ethylsulfanylhexadecanethioyloxy)propoxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[2,3-bis(16-ethylsulfanylhexadecanethioyloxy)propoxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[2,3-bis(16-ethylsulfanylhexadecanethioyloxy)propoxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[2,3-bis[16-(ethylthio)-1-sulfanylidenehexadecoxy]propoxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[2,3-bis(16-ethylsulfanylhexadecanethioyloxy)propoxy-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[2,3-bis[16-(ethylthio)hexadecanethioyloxy]propoxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C44H89NO6PS4+ MolecularWeight: 887.414321

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCCCCCCCCCCCCCCC(=S)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=S)CCCCCCCCCCCCCCCSCC

Isomeric SMILES

CCSCCCCCCCCCCCCCCCC(=S)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=S)CCCCCCCCCCCCCCCSCC

InChI

InChI=1S/C44H88NO6PS4/c1-6-55-38-32-28-24-20-16-12-8-10-14-18-22-26-30-34-43(53)48-40-42(41-50-52(46,47)49-37-36-45(3,4)5)51-44(54)35-31-27-23-19-15-11-9-13-17-21-25-29-33-39-56-7-2/h42H,6-41H2,1-5H3/p+1