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

Systemtic Name: di(docosyl)-methyl-[(2-oxidanylidenepyrrolidin-1-yl)methyl]azanium chloride Openeye Name: di(docosyl)-methyl-[(2-oxopyrrolidin-1-yl)methyl]ammonium chloride CAS Name: di(docosyl)-methyl-[(2-oxo-1-pyrrolidinyl)methyl]ammonium chloride IUPAC Name: di(docosyl)-methyl-[(2-oxopyrrolidin-1-yl)methyl]azanium chloride Traditional Name: dibehenyl-[(2-ketopyrrolidino)methyl]-methyl-ammonium chloride Formula: C50H101ClN2O MolecularWeight: 781.80274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C50H101N2O.ClH/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-47-52(3,49-51-46-44-45-50(51)53)48-43-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2;/h4-49H2,1-3H3;1H/q+1;/p-1