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

Systemtic Name: ethyl-[2-[oxidanyl-[2-propanoyloxy-3-(2-tetradecylphenoxy)propoxy]phosphanyl]oxyethyl]azanium Openeye Name: ethyl-[2-[hydroxy-[2-propanoyloxy-3-(2-tetradecylphenoxy)propoxy]phosphanyl]oxyethyl]ammonium CAS Name: ethyl-[2-[hydroxy-[2-(1-oxopropoxy)-3-(2-tetradecylphenoxy)propoxy]phosphino]oxyethyl]ammonium IUPAC Name: ethyl-[2-[hydroxy-[2-propanoyloxy-3-(2-tetradecylphenoxy)propoxy]phosphanyl]oxyethyl]azanium Traditional Name: ethyl-[2-[hydroxy-[3-(2-myristylphenoxy)-2-propionyloxy-propoxy]phosphino]oxyethyl]ammonium Formula: C30H55NO6P+ MolecularWeight: 556.734561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1=CC=CC=C1OCC(COP(O)OCC[NH2+]CC)OC(=O)CC

Isomeric SMILES

CCCCCCCCCCCCCCC1=CC=CC=C1OCC(COP(O)OCC[NH2+]CC)OC(=O)CC

InChI

InChI=1S/C30H54NO6P/c1-4-7-8-9-10-11-12-13-14-15-16-17-20-27-21-18-19-22-29(27)34-25-28(37-30(32)5-2)26-36-38(33)35-24-23-31-6-3/h18-19,21-22,28,31,33H,4-17,20,23-26H2,1-3H3/p+1