[1-[butoxy-(hexadecanoylamino)phosphoryl]-2-(hexadecanoylamino)-2-oxidanyl-ethyl]-trimethyl-azanium

Systemtic Name: [1-[butoxy-(hexadecanoylamino)phosphoryl]-2-(hexadecanoylamino)-2-oxidanyl-ethyl]-trimethyl-azanium Openeye Name: [1-[butoxy-(hexadecanoylamino)phosphoryl]-2-(hexadecanoylamino)-2-hydroxy-ethyl]-trimethyl-ammonium CAS Name: [1-[butoxy-(1-oxohexadecylamino)phosphoryl]-2-hydroxy-2-(1-oxohexadecylamino)ethyl]-trimethylammonium IUPAC Name: [1-[butoxy-(hexadecanoylamino)phosphoryl]-2-(hexadecanoylamino)-2-hydroxyethyl]-trimethylazanium Traditional Name: [1-[butoxy(palmitamido)phosphoryl]-2-hydroxy-2-palmitamido-ethyl]-trimethyl-ammonium Formula: C41H85N3O5P+ MolecularWeight: 731.104461

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC(C([N+](C)(C)C)P(=O)(NC(=O)CCCCCCCCCCCCCCC)OCCCC)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC(C([N+](C)(C)C)P(=O)(NC(=O)CCCCCCCCCCCCCCC)OCCCC)O

InChI

InChI=1S/C41H84N3O5P/c1-7-10-13-15-17-19-21-23-25-27-29-31-33-35-38(45)42-40(47)41(44(4,5)6)50(48,49-37-12-9-3)43-39(46)36-34-32-30-28-26-24-22-20-18-16-14-11-8-2/h40-41,47H,7-37H2,1-6H3,(H-,42,43,45,46,48)/p+1