2-[[(2R)-3-hexadecoxy-2-octanoylsulfanyl-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[(2R)-3-hexadecoxy-2-octanoylsulfanyl-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[(2R)-3-hexadecoxy-2-octanoylsulfanyl-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[(2R)-3-hexadecoxy-2-(1-oxooctylthio)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[(2R)-3-hexadecoxy-2-octanoylsulfanylpropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[(2R)-2-(caprylylthio)-3-cetyloxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C32H67NO6PS+ MolecularWeight: 624.916241

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(COP(=O)(O)OCC[N+](C)(C)C)SC(=O)CCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC[C@H](COP(=O)(O)OCC[N+](C)(C)C)SC(=O)CCCCCCC

InChI

InChI=1S/C32H66NO6PS/c1-6-8-10-12-13-14-15-16-17-18-19-20-22-24-27-37-29-31(41-32(34)25-23-21-11-9-7-2)30-39-40(35,36)38-28-26-33(3,4)5/h31H,6-30H2,1-5H3/p+1/t31-/m1/s1