trioctadecyl-[(2-oxidanylidenepyrrolidin-1-yl)methyl]azanium

Systemtic Name: trioctadecyl-[(2-oxidanylidenepyrrolidin-1-yl)methyl]azanium Openeye Name: trioctadecyl-[(2-oxopyrrolidin-1-yl)methyl]ammonium CAS Name: trioctadecyl-[(2-oxo-1-pyrrolidinyl)methyl]ammonium IUPAC Name: trioctadecyl-[(2-oxopyrrolidin-1-yl)methyl]azanium Traditional Name: (2-ketopyrrolidino)methyl-tristearyl-ammonium Formula: C59H119N2O+ MolecularWeight: 872.58896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](CCCCCCCCCCCCCCCCCC)(CCCCCCCCCCCCCCCCCC)CN1CCCC1=O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](CCCCCCCCCCCCCCCCCC)(CCCCCCCCCCCCCCCCCC)CN1CCCC1=O

InChI

InChI=1S/C59H119N2O/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55-61(58-60-54-52-53-59(60)62,56-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)57-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h4-58H2,1-3H3/q+1