(3-hexadecoxy-2-oxidanyl-propyl) 6-(trimethylazaniumyl)hexyl phosphate

Systemtic Name: (3-hexadecoxy-2-oxidanyl-propyl) 6-(trimethylazaniumyl)hexyl phosphate Openeye Name: (3-hexadecoxy-2-hydroxy-propyl) 6-(trimethylammonio)hexyl phosphate CAS Name: (3-hexadecoxy-2-hydroxypropyl) 6-(trimethylammonio)hexyl phosphate IUPAC Name: (3-hexadecoxy-2-hydroxypropyl) 6-(trimethylazaniumyl)hexyl phosphate Traditional Name: (3-cetyloxy-2-hydroxy-propyl) 6-(trimethylammonio)hexyl phosphate Formula: C28H60NO6P MolecularWeight: 537.752861

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCCCCCC[N+](C)(C)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCCCCCC[N+](C)(C)C)O

InChI

InChI=1S/C28H60NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-18-21-24-33-26-28(30)27-35-36(31,32)34-25-22-19-17-20-23-29(2,3)4/h28,30H,5-27H2,1-4H3