[(2R)-2,3-di(octadec-9-ynoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [(2R)-2,3-di(octadec-9-ynoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [(2R)-2,3-di(octadec-9-ynoyloxy)propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [(2R)-2,3-bis(1-oxooctadec-9-ynoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [(2R)-2,3-di(octadec-9-ynoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [(2R)-2,3-di(octadec-9-ynoyloxy)propyl] 2-(trimethylammonio)ethyl phosphate Formula: C44H80NO8P MolecularWeight: 782.081661

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC#CCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCC#CCCCCCCCC

Isomeric SMILES

CCCCCCCCC#CCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCC#CCCCCCCCC

InChI

InChI=1S/C44H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h42H,6-19,24-41H2,1-5H3/t42-/m1/s1