2-[[2-(dodecanoylamino)-1-oxidanyl-hexoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[2-(dodecanoylamino)-1-oxidanyl-hexoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[2-(dodecanoylamino)-1-hydroxy-hexoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[1-hydroxy-2-(1-oxododecylamino)hexoxy]phosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[2-(dodecanoylamino)-1-hydroxyhexoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[hydroxy-[1-hydroxy-2-(lauroylamino)hexoxy]phosphoryl]oxyethyl-trimethyl-ammonium Formula: C23H50N2O6P+ MolecularWeight: 481.626661

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC(CCCC)C(O)OP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCC(=O)NC(CCCC)C(O)OP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C23H49N2O6P/c1-6-8-10-11-12-13-14-15-16-18-22(26)24-21(17-9-7-2)23(27)31-32(28,29)30-20-19-25(3,4)5/h21,23,27H,6-20H2,1-5H3,(H-,24,26,28,29)/p+1