trimethyl-[2-[oxidanyl-[2-(2-oxidanylidenepropyl)henicosoxy]phosphoryl]ethyl]azanium

Systemtic Name: trimethyl-[2-[oxidanyl-[2-(2-oxidanylidenepropyl)henicosoxy]phosphoryl]ethyl]azanium Openeye Name: 2-[2-acetonylhenicosoxy(hydroxy)phosphoryl]ethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[2-(2-oxopropyl)heneicosoxy]phosphoryl]ethyl-trimethylammonium IUPAC Name: 2-[hydroxy-[2-(2-oxopropyl)henicosoxy]phosphoryl]ethyl-trimethylazanium Traditional Name: 2-[2-acetonylheneicosoxy(hydroxy)phosphoryl]ethyl-trimethyl-ammonium Formula: C29H61NO4P+ MolecularWeight: 518.772701

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC(CC(=O)C)COP(=O)(CC[N+](C)(C)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC(CC(=O)C)COP(=O)(CC[N+](C)(C)C)O

InChI

InChI=1S/C29H60NO4P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-29(26-28(2)31)27-34-35(32,33)25-24-30(3,4)5/h29H,6-27H2,1-5H3/p+1