[2-[butoxy-(11-methylpentadecanoylamino)phosphoryl]-2-(11-methylpentadecanoylamino)-2-oxidanyl-ethyl]-trimethyl-azanium

Systemtic Name: [2-[butoxy-(11-methylpentadecanoylamino)phosphoryl]-2-(11-methylpentadecanoylamino)-2-oxidanyl-ethyl]-trimethyl-azanium Openeye Name: [2-[butoxy-(11-methylpentadecanoylamino)phosphoryl]-2-hydroxy-2-(11-methylpentadecanoylamino)ethyl]-trimethyl-ammonium CAS Name: [2-[butoxy-[(11-methyl-1-oxopentadecyl)amino]phosphoryl]-2-hydroxy-2-[(11-methyl-1-oxopentadecyl)amino]ethyl]-trimethylammonium IUPAC Name: [2-[butoxy-(11-methylpentadecanoylamino)phosphoryl]-2-hydroxy-2-(11-methylpentadecanoylamino)ethyl]-trimethylazanium Traditional Name: [2-[butoxy-(11-methylpentadecanoylamino)phosphoryl]-2-hydroxy-2-(11-methylpentadecanoylamino)ethyl]-trimethyl-ammonium Formula: C41H85N3O5P+ MolecularWeight: 731.104461

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)CCCCCCCCCC(=O)NC(C[N+](C)(C)C)(O)P(=O)(NC(=O)CCCCCCCCCC(C)CCCC)OCCCC

Isomeric SMILES

CCCCC(C)CCCCCCCCCC(=O)NC(C[N+](C)(C)C)(O)P(=O)(NC(=O)CCCCCCCCCC(C)CCCC)OCCCC

InChI

InChI=1S/C41H84N3O5P/c1-9-12-29-37(4)31-25-21-17-15-19-23-27-33-39(45)42-41(47,36-44(6,7)8)50(48,49-35-14-11-3)43-40(46)34-28-24-20-16-18-22-26-32-38(5)30-13-10-2/h37-38,47H,9-36H2,1-8H3,(H-,42,43,45,46,48)/p+1