2-[[(2S)-3-decanoyloxy-2-undecanoyloxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[(2S)-3-decanoyloxy-2-undecanoyloxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[(2S)-3-decanoyloxy-2-undecanoyloxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[(2S)-3-(1-oxodecoxy)-2-(1-oxoundecoxy)propoxy]phosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[(2S)-3-decanoyloxy-2-undecanoyloxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[(2S)-3-capryloxy-2-undecanoyloxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C29H59NO8P+ MolecularWeight: 580.754421

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCC)COP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCCCC)COP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C29H58NO8P/c1-6-8-10-12-14-16-18-20-22-29(32)38-27(26-37-39(33,34)36-24-23-30(3,4)5)25-35-28(31)21-19-17-15-13-11-9-7-2/h27H,6-26H2,1-5H3/p+1/t27-/m0/s1