methyl-[2-[oxidanyl-[2-(2-oxidanylidenebutyl)octadecoxy]phosphoryl]oxyethyl]azanium

Systemtic Name: methyl-[2-[oxidanyl-[2-(2-oxidanylidenebutyl)octadecoxy]phosphoryl]oxyethyl]azanium Openeye Name: 2-[hydroxy-[2-(2-oxobutyl)octadecoxy]phosphoryl]oxyethyl-methyl-ammonium CAS Name: 2-[hydroxy-[2-(2-oxobutyl)octadecoxy]phosphoryl]oxyethyl-methylammonium IUPAC Name: 2-[hydroxy-[2-(2-oxobutyl)octadecoxy]phosphoryl]oxyethyl-methylazanium Traditional Name: 2-[hydroxy-[2-(2-ketobutyl)octadecoxy]phosphoryl]oxyethyl-methyl-ammonium Formula: C25H53NO5P+ MolecularWeight: 478.665781

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CC(=O)CC)COP(=O)(O)OCC[NH2+]C

Isomeric SMILES

CCCCCCCCCCCCCCCCC(CC(=O)CC)COP(=O)(O)OCC[NH2+]C

InChI

InChI=1S/C25H52NO5P/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24(22-25(27)5-2)23-31-32(28,29)30-21-20-26-3/h24,26H,4-23H2,1-3H3,(H,28,29)/p+1