(3-dodecanoyloxy-2-heptadecanoyloxy-propyl) 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: (3-dodecanoyloxy-2-heptadecanoyloxy-propyl) 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: (3-dodecanoyloxy-2-heptadecanoyloxy-propyl) 2-(trimethylammonio)ethyl phosphate CAS Name: [3-(1-oxododecoxy)-2-(1-oxoheptadecoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: (3-dodecanoyloxy-2-heptadecanoyloxypropyl) 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: (2-heptadecanoyloxy-3-lauroyloxy-propyl) 2-(trimethylammonio)ethyl phosphate Formula: C37H74NO8P MolecularWeight: 691.959121

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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