dimethyl-[3-[oxidanyl-[2-(2-oxidanylidenebutyl)octadecoxy]phosphoryl]oxypropyl]azanium

Systemtic Name: dimethyl-[3-[oxidanyl-[2-(2-oxidanylidenebutyl)octadecoxy]phosphoryl]oxypropyl]azanium Openeye Name: 3-[hydroxy-[2-(2-oxobutyl)octadecoxy]phosphoryl]oxypropyl-dimethyl-ammonium CAS Name: 3-[hydroxy-[2-(2-oxobutyl)octadecoxy]phosphoryl]oxypropyl-dimethylammonium IUPAC Name: 3-[hydroxy-[2-(2-oxobutyl)octadecoxy]phosphoryl]oxypropyl-dimethylazanium Traditional Name: 3-[hydroxy-[2-(2-ketobutyl)octadecoxy]phosphoryl]oxypropyl-dimethyl-ammonium Formula: C27H57NO5P+ MolecularWeight: 506.718941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CC(=O)CC)COP(=O)(O)OCCC[NH+](C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCC(CC(=O)CC)COP(=O)(O)OCCC[NH+](C)C

InChI

InChI=1S/C27H56NO5P/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-21-26(24-27(29)6-2)25-33-34(30,31)32-23-20-22-28(3)4/h26H,5-25H2,1-4H3,(H,30,31)/p+1