trimethyl-[4-[oxidanyl-[2-(2-oxidanylidenebutyl)icosoxy]phosphoryl]oxybutyl]azanium

Systemtic Name: trimethyl-[4-[oxidanyl-[2-(2-oxidanylidenebutyl)icosoxy]phosphoryl]oxybutyl]azanium Openeye Name: 4-[hydroxy-[2-(2-oxobutyl)icosoxy]phosphoryl]oxybutyl-trimethyl-ammonium CAS Name: 4-[hydroxy-[2-(2-oxobutyl)eicosoxy]phosphoryl]oxybutyl-trimethylammonium IUPAC Name: 4-[hydroxy-[2-(2-oxobutyl)icosoxy]phosphoryl]oxybutyl-trimethylazanium Traditional Name: 4-[hydroxy-[2-(2-ketobutyl)eicosoxy]phosphoryl]oxybutyl-trimethyl-ammonium Formula: C31H65NO5P+ MolecularWeight: 562.825261

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(CC(=O)CC)COP(=O)(O)OCCCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(CC(=O)CC)COP(=O)(O)OCCCC[N+](C)(C)C

InChI

InChI=1S/C31H64NO5P/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-30(28-31(33)7-2)29-37-38(34,35)36-27-24-23-26-32(3,4)5/h30H,6-29H2,1-5H3/p+1