2-[[1-icosoxy-3-(phenethylamino)propan-2-yl]oxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[1-icosoxy-3-(phenethylamino)propan-2-yl]oxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[hydroxy-[1-(icosoxymethyl)-2-(phenethylamino)ethoxy]phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[1-eicosoxy-3-(phenethylamino)propan-2-yl]oxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[hydroxy-[1-icosoxy-3-(phenethylamino)propan-2-yl]oxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[1-(arachyloxymethyl)-2-(phenethylamino)ethoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C36H70N2O5P+ MolecularWeight: 641.925161

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCOCC(CNCCC1=CC=CC=C1)OP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCOCC(CNCCC1=CC=CC=C1)OP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C36H69N2O5P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-31-41-34-36(33-37-29-28-35-26-23-22-24-27-35)43-44(39,40)42-32-30-38(2,3)4/h22-24,26-27,36-37H,5-21,25,28-34H2,1-4H3/p+1