[2-nonoxy-3-(octadecanoylamino)propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [2-nonoxy-3-(octadecanoylamino)propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [2-nonoxy-3-(octadecanoylamino)propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [2-nonoxy-3-(1-oxooctadecylamino)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [2-nonoxy-3-(octadecanoylamino)propyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: (2-nonoxy-3-stearamido-propyl) 2-(trimethylammonio)ethyl phosphate Formula: C35H73N2O6P MolecularWeight: 648.937681

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCC(COP(=O)([O-])OCC[N+](C)(C)C)OCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCC(COP(=O)([O-])OCC[N+](C)(C)C)OCCCCCCCCC

InChI

InChI=1S/C35H73N2O6P/c1-6-8-10-12-14-15-16-17-18-19-20-21-22-24-26-28-35(38)36-32-34(41-30-27-25-23-13-11-9-7-2)33-43-44(39,40)42-31-29-37(3,4)5/h34H,6-33H2,1-5H3,(H-,36,38,39,40)