1-[[2-dodecanoyloxy-3-[(E)-octadec-9-enoyl]oxy-propoxy]-oxidanyl-phosphoryl]propyl-trimethyl-azanium

Systemtic Name: 1-[[2-dodecanoyloxy-3-[(E)-octadec-9-enoyl]oxy-propoxy]-oxidanyl-phosphoryl]propyl-trimethyl-azanium Openeye Name: 1-[[2-dodecanoyloxy-3-[(E)-octadec-9-enoyl]oxy-propoxy]-hydroxy-phosphoryl]propyl-trimethyl-ammonium CAS Name: 1-[hydroxy-[2-(1-oxododecoxy)-3-[(E)-1-oxooctadec-9-enoxy]propoxy]phosphoryl]propyl-trimethylammonium IUPAC Name: 1-[[2-dodecanoyloxy-3-[(E)-octadec-9-enoyl]oxypropoxy]-hydroxyphosphoryl]propyl-trimethylazanium Traditional Name: 1-[hydroxy-[2-lauroyloxy-3-[(E)-octadec-9-enoyl]oxy-propoxy]phosphoryl]propyl-trimethyl-ammonium Formula: C39H77NO7P+ MolecularWeight: 703.004941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(C(CC)[N+](C)(C)C)O

Isomeric SMILES

CCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCC/C=C/CCCCCCCC)COP(=O)(C(CC)[N+](C)(C)C)O

InChI

InChI=1S/C39H76NO7P/c1-7-10-12-14-16-18-19-20-21-22-23-25-26-28-30-32-38(41)45-34-36(35-46-48(43,44)37(9-3)40(4,5)6)47-39(42)33-31-29-27-24-17-15-13-11-8-2/h20-21,36-37H,7-19,22-35H2,1-6H3/p+1/b21-20+