(3-hexadecanoyloxy-2-tridecanoyloxy-propyl) 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: (3-hexadecanoyloxy-2-tridecanoyloxy-propyl) 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: (3-hexadecanoyloxy-2-tridecanoyloxy-propyl) 2-(trimethylammonio)ethyl phosphate CAS Name: [3-(1-oxohexadecoxy)-2-(1-oxotridecoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: (3-hexadecanoyloxy-2-tridecanoyloxypropyl) 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: (3-hexadecanoyloxy-2-tridecanoyloxy-propyl) 2-(trimethylammonio)ethyl phosphate Formula: C37H74NO8P MolecularWeight: 691.959121

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCC

InChI

InChI=1S/C37H74NO8P/c1-6-8-10-12-14-16-18-19-20-22-23-25-27-29-36(39)43-33-35(34-45-47(41,42)44-32-31-38(3,4)5)46-37(40)30-28-26-24-21-17-15-13-11-9-7-2/h35H,6-34H2,1-5H3