(3-acetyloxy-4-hexadecoxy-butyl) 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: (3-acetyloxy-4-hexadecoxy-butyl) 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: (3-acetoxy-4-hexadecoxy-butyl) 2-(trimethylammonio)ethyl phosphate CAS Name: (3-acetyloxy-4-hexadecoxybutyl) 2-(trimethylammonio)ethyl phosphate IUPAC Name: (3-acetyloxy-4-hexadecoxybutyl) 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: (3-acetoxy-4-cetyloxy-butyl) 2-(trimethylammonio)ethyl phosphate Formula: C27H56NO7P MolecularWeight: 537.709801

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(CCOP(=O)([O-])OCC[N+](C)(C)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(CCOP(=O)([O-])OCC[N+](C)(C)C)OC(=O)C

InChI

InChI=1S/C27H56NO7P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-32-25-27(35-26(2)29)20-23-33-36(30,31)34-24-21-28(3,4)5/h27H,6-25H2,1-5H3