ethyl-hexadecyl-[2-(octadecanoylamino)ethyl]-[(2-oxidanylidenepyrrolidin-1-yl)methyl]azanium

Systemtic Name: ethyl-hexadecyl-[2-(octadecanoylamino)ethyl]-[(2-oxidanylidenepyrrolidin-1-yl)methyl]azanium Openeye Name: ethyl-hexadecyl-[2-(octadecanoylamino)ethyl]-[(2-oxopyrrolidin-1-yl)methyl]ammonium CAS Name: ethyl-hexadecyl-[2-(1-oxooctadecylamino)ethyl]-[(2-oxo-1-pyrrolidinyl)methyl]ammonium IUPAC Name: ethyl-hexadecyl-[2-(octadecanoylamino)ethyl]-[(2-oxopyrrolidin-1-yl)methyl]azanium Traditional Name: cetyl-ethyl-[(2-ketopyrrolidino)methyl]-(2-stearamidoethyl)ammonium Formula: C43H86N3O2+ MolecularWeight: 677.16184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCC[N+](CC)(CCCCCCCCCCCCCCCC)CN1CCCC1=O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCC[N+](CC)(CCCCCCCCCCCCCCCC)CN1CCCC1=O

InChI

InChI=1S/C43H85N3O2/c1-4-7-9-11-13-15-17-19-21-22-24-26-28-30-32-35-42(47)44-37-40-46(6-3,41-45-38-34-36-43(45)48)39-33-31-29-27-25-23-20-18-16-14-12-10-8-5-2/h4-41H2,1-3H3/p+1