(2-acetyloxy-3-hexadecoxy-butyl) 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: (2-acetyloxy-3-hexadecoxy-butyl) 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: (2-acetoxy-3-hexadecoxy-butyl) 2-(trimethylammonio)ethyl phosphate CAS Name: (2-acetyloxy-3-hexadecoxybutyl) 2-(trimethylammonio)ethyl phosphate IUPAC Name: (2-acetyloxy-3-hexadecoxybutyl) 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: (2-acetoxy-3-cetyloxy-butyl) 2-(trimethylammonio)ethyl phosphate Formula: C27H56NO7P MolecularWeight: 537.709801

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H56NO7P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-32-25(2)27(35-26(3)29)24-34-36(30,31)33-23-21-28(4,5)6/h25,27H,7-24H2,1-6H3