2-[[2-(dioxidanyl)-3-dodecanoyloxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[2-(dioxidanyl)-3-dodecanoyloxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[(3-dodecanoyloxy-2-hydroperoxy-propoxy)-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[2-hydroperoxy-3-(1-oxododecoxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[(3-dodecanoyloxy-2-hydroperoxypropoxy)-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[(2-hydroperoxy-3-lauroyloxy-propoxy)-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C20H43NO8P+ MolecularWeight: 456.531081

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OO

Isomeric SMILES

CCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OO

InChI

InChI=1S/C20H42NO8P/c1-5-6-7-8-9-10-11-12-13-14-20(22)26-17-19(29-23)18-28-30(24,25)27-16-15-21(2,3)4/h19H,5-18H2,1-4H3,(H-,23,24,25)/p+1