trimethyl-[3-[oxidanyl-[2-(2-oxidanylidenepropyl)icosoxy]phosphoryl]oxypropyl]azanium

Systemtic Name: trimethyl-[3-[oxidanyl-[2-(2-oxidanylidenepropyl)icosoxy]phosphoryl]oxypropyl]azanium Openeye Name: 3-[2-acetonylicosoxy(hydroxy)phosphoryl]oxypropyl-trimethyl-ammonium CAS Name: 3-[hydroxy-[2-(2-oxopropyl)eicosoxy]phosphoryl]oxypropyl-trimethylammonium IUPAC Name: 3-[hydroxy-[2-(2-oxopropyl)icosoxy]phosphoryl]oxypropyl-trimethylazanium Traditional Name: 3-[2-acetonyleicosoxy(hydroxy)phosphoryl]oxypropyl-trimethyl-ammonium Formula: C29H61NO5P+ MolecularWeight: 534.772101

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H60NO5P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-29(26-28(2)31)27-35-36(32,33)34-25-22-24-30(3,4)5/h29H,6-27H2,1-5H3/p+1