(3-decanoyloxy-2-undecanoyloxy-propyl) 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: (3-decanoyloxy-2-undecanoyloxy-propyl) 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: (3-decanoyloxy-2-undecanoyloxy-propyl) 2-(trimethylammonio)ethyl phosphate CAS Name: [3-(1-oxodecoxy)-2-(1-oxoundecoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: (3-decanoyloxy-2-undecanoyloxypropyl) 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: (3-capryloxy-2-undecanoyloxy-propyl) 2-(trimethylammonio)ethyl phosphate Formula: C29H58NO8P MolecularWeight: 579.746481

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C29H58NO8P/c1-6-8-10-12-14-16-18-20-22-29(32)38-27(26-37-39(33,34)36-24-23-30(3,4)5)25-35-28(31)21-19-17-15-13-11-9-7-2/h27H,6-26H2,1-5H3