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

Systemtic Name: 2-[[1-(icosylamino)-3-octadecoxy-propan-2-yl]oxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[hydroxy-[1-[(icosylamino)methyl]-2-octadecoxy-ethoxy]phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[1-(eicosylamino)-3-octadecoxypropan-2-yl]oxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[hydroxy-[1-(icosylamino)-3-octadecoxypropan-2-yl]oxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[1-[(arachylamino)methyl]-2-stearyloxy-ethoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C46H98N2O5P+ MolecularWeight: 790.254481

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCNCC(COCCCCCCCCCCCCCCCCCC)OP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCNCC(COCCCCCCCCCCCCCCCCCC)OP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C46H97N2O5P/c1-6-8-10-12-14-16-18-20-22-24-25-26-28-30-32-34-36-38-40-47-44-46(53-54(49,50)52-43-41-48(3,4)5)45-51-42-39-37-35-33-31-29-27-23-21-19-17-15-13-11-9-7-2/h46-47H,6-45H2,1-5H3/p+1