(2-methoxy-3-octadecoxy-propyl) 6-(trimethylazaniumyl)hexyl phosphate

Systemtic Name: (2-methoxy-3-octadecoxy-propyl) 6-(trimethylazaniumyl)hexyl phosphate Openeye Name: (2-methoxy-3-octadecoxy-propyl) 6-(trimethylammonio)hexyl phosphate CAS Name: (2-methoxy-3-octadecoxypropyl) 6-(trimethylammonio)hexyl phosphate IUPAC Name: (2-methoxy-3-octadecoxypropyl) 6-(trimethylazaniumyl)hexyl phosphate Traditional Name: (2-methoxy-3-stearyloxy-propyl) 6-(trimethylammonio)hexyl phosphate Formula: C31H66NO6P MolecularWeight: 579.832601

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H66NO6P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-24-27-36-29-31(35-5)30-38-39(33,34)37-28-25-22-20-23-26-32(2,3)4/h31H,6-30H2,1-5H3