trimethyl-[2-[2-[[(E)-octadec-9-enyl]carbamoyloxy]icosoxy-oxidanyl-phosphoryl]oxyethyl]azanium

Systemtic Name: trimethyl-[2-[2-[[(E)-octadec-9-enyl]carbamoyloxy]icosoxy-oxidanyl-phosphoryl]oxyethyl]azanium Openeye Name: 2-[hydroxy-[2-[[(E)-octadec-9-enyl]carbamoyloxy]icosoxy]phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[2-[[[(E)-octadec-9-enyl]amino]-oxomethoxy]eicosoxy]phosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[hydroxy-[2-[[(E)-octadec-9-enyl]carbamoyloxy]icosoxy]phosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[hydroxy-[2-[[(E)-octadec-9-enyl]carbamoyloxy]eicosoxy]phosphoryl]oxyethyl-trimethyl-ammonium Formula: C44H90N2O6P+ MolecularWeight: 774.168961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)NCCCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)NCCCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C44H89N2O6P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-43(42-51-53(48,49)50-41-40-46(3,4)5)52-44(47)45-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h21,23,43H,6-20,22,24-42H2,1-5H3,(H-,45,47,48,49)/p+1/b23-21+