trimethyl-[2-[oxidanyl-[2-propanoyloxy-3-(3-tetradecylphenoxy)propoxy]phosphanyl]oxyethyl]azanium

Systemtic Name: trimethyl-[2-[oxidanyl-[2-propanoyloxy-3-(3-tetradecylphenoxy)propoxy]phosphanyl]oxyethyl]azanium Openeye Name: 2-[hydroxy-[2-propanoyloxy-3-(3-tetradecylphenoxy)propoxy]phosphanyl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[2-(1-oxopropoxy)-3-(3-tetradecylphenoxy)propoxy]phosphino]oxyethyl-trimethylammonium IUPAC Name: 2-[hydroxy-[2-propanoyloxy-3-(3-tetradecylphenoxy)propoxy]phosphanyl]oxyethyl-trimethylazanium Traditional Name: 2-[hydroxy-[3-(3-myristylphenoxy)-2-propionyloxy-propoxy]phosphino]oxyethyl-trimethyl-ammonium Formula: C31H57NO6P+ MolecularWeight: 570.761141

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1=CC(=CC=C1)OCC(COP(O)OCC[N+](C)(C)C)OC(=O)CC

Isomeric SMILES

CCCCCCCCCCCCCCC1=CC(=CC=C1)OCC(COP(O)OCC[N+](C)(C)C)OC(=O)CC

InChI

InChI=1S/C31H57NO6P/c1-6-8-9-10-11-12-13-14-15-16-17-18-20-28-21-19-22-29(25-28)35-26-30(38-31(33)7-2)27-37-39(34)36-24-23-32(3,4)5/h19,21-22,25,30,34H,6-18,20,23-24,26-27H2,1-5H3/q+1