bis(3-octadecoxypropyl)-octadecyl-[(2-oxidanylidenepyrrolidin-1-yl)methyl]azanium

Systemtic Name: bis(3-octadecoxypropyl)-octadecyl-[(2-oxidanylidenepyrrolidin-1-yl)methyl]azanium Openeye Name: bis(3-octadecoxypropyl)-octadecyl-[(2-oxopyrrolidin-1-yl)methyl]ammonium CAS Name: bis(3-octadecoxypropyl)-octadecyl-[(2-oxo-1-pyrrolidinyl)methyl]ammonium IUPAC Name: bis(3-octadecoxypropyl)-octadecyl-[(2-oxopyrrolidin-1-yl)methyl]azanium Traditional Name: (2-ketopyrrolidino)methyl-stearyl-bis(3-stearyloxypropyl)ammonium Formula: C65H131N2O3+ MolecularWeight: 988.74724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C65H131N2O3/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-57-67(64-66-56-52-55-65(66)68,58-53-62-69-60-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)59-54-63-70-61-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h4-64H2,1-3H3/q+1