[2-(dimethylamino)-3-octadecoxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [2-(dimethylamino)-3-octadecoxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [2-(dimethylamino)-3-octadecoxy-propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [2-(dimethylamino)-3-octadecoxypropyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [2-(dimethylamino)-3-octadecoxypropyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [2-(dimethylamino)-3-stearyloxy-propyl] 2-(trimethylammonio)ethyl phosphate Formula: C28H61N2O5P MolecularWeight: 536.768101

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCC[N+](C)(C)C)N(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCC[N+](C)(C)C)N(C)C

InChI

InChI=1S/C28H61N2O5P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-33-26-28(29(2)3)27-35-36(31,32)34-25-23-30(4,5)6/h28H,7-27H2,1-6H3