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trimethyl-[2-[[2-(nonadecanoylamino)-3-oxidanyl-octadecoxy]-oxidanyl-phosphoryl]oxyethyl]azanium

trimethyl-[2-[[2-(nonadecanoylamino)-3-oxidanyl-octadecoxy]-oxidanyl-phosphoryl]oxyethyl]azanium

Systemtic Name:trimethyl-[2-[[2-(nonadecanoylamino)-3-oxidanyl-octadecoxy]-oxidanyl-phosphoryl]oxyethyl]azanium
Openeye Name:2-[hydroxy-[3-hydroxy-2-(nonadecanoylamino)octadecoxy]phosphoryl]oxyethyl-trimethyl-ammonium
CAS Name:2-[hydroxy-[3-hydroxy-2-(1-oxononadecylamino)octadecoxy]phosphoryl]oxyethyl-trimethylammonium
IUPAC Name:2-[hydroxy-[3-hydroxy-2-(nonadecanoylamino)octadecoxy]phosphoryl]oxyethyl-trimethylazanium
Traditional Name:2-[hydroxy-[3-hydroxy-2-(nonadecanoylamino)octadecoxy]phosphoryl]oxyethyl-trimethyl-ammonium
Formula: C42H88N2O6P+
MolecularWeight: 748.131681
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(=O)NC(COP(=O)(O)OCC[N+](C)(C)C)C(CCCCCCCCCCCCCCC)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(=O)NC(COP(=O)(O)OCC[N+](C)(C)C)C(CCCCCCCCCCCCCCC)O


InChI

InChI=1S/C42H87N2O6P/c1-6-8-10-12-14-16-18-20-21-22-24-26-28-30-32-34-36-42(46)43-40(39-50-51(47,48)49-38-37-44(3,4)5)41(45)35-33-31-29-27-25-23-19-17-15-13-11-9-7-2/h40-41,45H,6-39H2,1-5H3,(H-,43,46,47,48)/p+1


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