2-[icosyl(phenylmethoxycarbonyl)amino]ethyl 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: 2-[icosyl(phenylmethoxycarbonyl)amino]ethyl 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: 2-[benzyloxycarbonyl(icosyl)amino]ethyl 2-(trimethylammonio)ethyl phosphate CAS Name: 2-[eicosyl(phenylmethoxycarbonyl)amino]ethyl 2-(trimethylammonio)ethyl phosphate IUPAC Name: 2-[icosyl(phenylmethoxycarbonyl)amino]ethyl 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: 2-[arachyl(carbobenzoxy)amino]ethyl 2-(trimethylammonio)ethyl phosphate Formula: C35H65N2O6P MolecularWeight: 640.874161

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCN(CCOP(=O)([O-])OCC[N+](C)(C)C)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCN(CCOP(=O)([O-])OCC[N+](C)(C)C)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C35H65N2O6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-28-36(35(38)41-33-34-26-23-22-24-27-34)29-31-42-44(39,40)43-32-30-37(2,3)4/h22-24,26-27H,5-21,25,28-33H2,1-4H3