trimethyl-[2-[(2-nonanoyloxy-3-tridecanoyloxy-propoxy)-oxidanyl-phosphoryl]oxyethyl]azanium

Systemtic Name: trimethyl-[2-[(2-nonanoyloxy-3-tridecanoyloxy-propoxy)-oxidanyl-phosphoryl]oxyethyl]azanium Openeye Name: 2-[hydroxy-(2-nonanoyloxy-3-tridecanoyloxy-propoxy)phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[2-(1-oxononoxy)-3-(1-oxotridecoxy)propoxy]phosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[hydroxy-(2-nonanoyloxy-3-tridecanoyloxypropoxy)phosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[hydroxy-(2-pelargonyloxy-3-tridecanoyloxy-propoxy)phosphoryl]oxyethyl-trimethyl-ammonium Formula: C30H61NO8P+ MolecularWeight: 594.781001

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCCC

InChI

InChI=1S/C30H60NO8P/c1-6-8-10-12-14-15-16-17-19-20-22-29(32)36-26-28(39-30(33)23-21-18-13-11-9-7-2)27-38-40(34,35)37-25-24-31(3,4)5/h28H,6-27H2,1-5H3/p+1