2-[[2-acetyloxy-3-[(9E,12E)-octadeca-9,12-dienoxy]propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[2-acetyloxy-3-[(9E,12E)-octadeca-9,12-dienoxy]propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[2-acetoxy-3-[(9E,12E)-octadeca-9,12-dienoxy]propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[2-acetyloxy-3-[(9E,12E)-octadeca-9,12-dienoxy]propoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[2-acetyloxy-3-[(9E,12E)-octadeca-9,12-dienoxy]propoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[2-acetoxy-3-[(9E,12E)-octadeca-9,12-dienoxy]propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C28H55NO7P+ MolecularWeight: 548.712561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCCOCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)C

Isomeric SMILES

CCCCC/C=C/C/C=C/CCCCCCCCOCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)C

InChI

InChI=1S/C28H54NO7P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-33-25-28(36-27(2)30)26-35-37(31,32)34-24-22-29(3,4)5/h10-11,13-14,28H,6-9,12,15-26H2,1-5H3/p+1/b11-10+,14-13+