[1-dodecoxy-3-(hexadecylamino)propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [1-dodecoxy-3-(hexadecylamino)propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [1-(dodecoxymethyl)-2-(hexadecylamino)ethyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [1-dodecoxy-3-(hexadecylamino)propan-2-yl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [1-dodecoxy-3-(hexadecylamino)propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [1-[(cetylamino)methyl]-2-lauryloxy-ethyl] 2-(trimethylammonio)ethyl phosphate Formula: C36H77N2O5P MolecularWeight: 648.980741

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNCC(COCCCCCCCCCCCC)OP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCNCC(COCCCCCCCCCCCC)OP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C36H77N2O5P/c1-6-8-10-12-14-16-18-19-20-21-22-24-26-28-30-37-34-36(43-44(39,40)42-33-31-38(3,4)5)35-41-32-29-27-25-23-17-15-13-11-9-7-2/h36-37H,6-35H2,1-5H3