methyl-dioctadecyl-[(2-oxidanylidenepyrrolidin-1-yl)methyl]azanium chloride

Systemtic Name: methyl-dioctadecyl-[(2-oxidanylidenepyrrolidin-1-yl)methyl]azanium chloride Openeye Name: methyl-dioctadecyl-[(2-oxopyrrolidin-1-yl)methyl]ammonium chloride CAS Name: methyl-dioctadecyl-[(2-oxo-1-pyrrolidinyl)methyl]ammonium chloride IUPAC Name: methyl-dioctadecyl-[(2-oxopyrrolidin-1-yl)methyl]azanium chloride Traditional Name: (2-ketopyrrolidino)methyl-methyl-distearyl-ammonium chloride Formula: C42H85ClN2O MolecularWeight: 669.5901

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](C)(CCCCCCCCCCCCCCCCCC)CN1CCCC1=O.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](C)(CCCCCCCCCCCCCCCCCC)CN1CCCC1=O.[Cl-]

InChI

InChI=1S/C42H85N2O.ClH/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-39-44(3,41-43-38-36-37-42(43)45)40-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2;/h4-41H2,1-3H3;1H/q+1;/p-1