2-[[2-(12-azanyldodecanoyloxy)-3-octadecanoyloxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[2-(12-azanyldodecanoyloxy)-3-octadecanoyloxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[2-(12-aminododecanoyloxy)-3-octadecanoyloxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[2-(12-amino-1-oxododecoxy)-3-(1-oxooctadecoxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[2-(12-aminododecanoyloxy)-3-octadecanoyloxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[2-(12-aminododecanoyloxy)-3-stearoyloxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C38H78N2O8P+ MolecularWeight: 722.008281

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCN

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCN

InChI

InChI=1S/C38H77N2O8P/c1-5-6-7-8-9-10-11-12-13-14-15-17-20-23-26-29-37(41)45-34-36(35-47-49(43,44)46-33-32-40(2,3)4)48-38(42)30-27-24-21-18-16-19-22-25-28-31-39/h36H,5-35,39H2,1-4H3/p+1