2-[[(2R)-2,3-di(hexadecanoyloxy)propoxy]-oxidanyl-phosphinothioyl]oxyethyl-triethyl-azanium

Systemtic Name: 2-[[(2R)-2,3-di(hexadecanoyloxy)propoxy]-oxidanyl-phosphinothioyl]oxyethyl-triethyl-azanium Openeye Name: 2-[[(2R)-2,3-di(hexadecanoyloxy)propoxy]-hydroxy-phosphinothioyl]oxyethyl-triethyl-ammonium CAS Name: 2-[[(2R)-2,3-bis(1-oxohexadecoxy)propoxy]-hydroxyphosphinothioyl]oxyethyl-triethylammonium IUPAC Name: 2-[[(2R)-2,3-di(hexadecanoyloxy)propoxy]-hydroxyphosphinothioyl]oxyethyl-triethylazanium Traditional Name: 2-[[(2R)-2,3-di(hexadecanoyloxy)propoxy]-hydroxy-thiophosphoryl]oxyethyl-triethyl-ammonium Formula: C43H87NO7PS+ MolecularWeight: 793.192141

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COP(=S)(O)OCC[N+](CC)(CC)CC)OC(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=S)(O)OCC[N+](CC)(CC)CC)OC(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C43H86NO7PS/c1-6-11-13-15-17-19-21-23-25-27-29-31-33-35-42(45)48-39-41(40-50-52(47,53)49-38-37-44(8-3,9-4)10-5)51-43(46)36-34-32-30-28-26-24-22-20-18-16-14-12-7-2/h41H,6-40H2,1-5H3/p+1/t41-,52?/m1/s1