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

Systemtic Name: 2-[[1-(hexadecylcarbamoylamino)-3-icosoxy-propan-2-yl]oxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[1-[(hexadecylcarbamoylamino)methyl]-2-icosoxy-ethoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[1-eicosoxy-3-[[(hexadecylamino)-oxomethyl]amino]propan-2-yl]oxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[1-(hexadecylcarbamoylamino)-3-icosoxypropan-2-yl]oxy-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[1-(arachyloxymethyl)-2-(cetylcarbamoylamino)ethoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C45H95N3O6P+ MolecularWeight: 805.226061

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCOCC(CNC(=O)NCCCCCCCCCCCCCCCC)OP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCOCC(CNC(=O)NCCCCCCCCCCCCCCCC)OP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C45H94N3O6P/c1-6-8-10-12-14-16-18-20-22-23-24-25-27-29-31-33-35-37-40-52-43-44(54-55(50,51)53-41-39-48(3,4)5)42-47-45(49)46-38-36-34-32-30-28-26-21-19-17-15-13-11-9-7-2/h44H,6-43H2,1-5H3,(H2-,46,47,49,50,51)/p+1