N-[2-(2-heptadecyl-1-methyl-4,5-dihydroimidazol-1-ium-1-yl)ethyl]hexadecanamide

Systemtic Name: N-[2-(2-heptadecyl-1-methyl-4,5-dihydroimidazol-1-ium-1-yl)ethyl]hexadecanamide Openeye Name: N-[2-(2-heptadecyl-1-methyl-4,5-dihydroimidazol-1-ium-1-yl)ethyl]hexadecanamide CAS Name: N-[2-(2-heptadecyl-1-methyl-4,5-dihydroimidazol-1-ium-1-yl)ethyl]hexadecanamide IUPAC Name: N-[2-(2-heptadecyl-1-methyl-4,5-dihydroimidazol-1-ium-1-yl)ethyl]hexadecanamide Traditional Name: N-[2-(2-heptadecyl-1-methyl-2-imidazolin-1-ium-1-yl)ethyl]palmitamide Formula: C39H78N3O+ MolecularWeight: 605.05612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=NCC[N+]1(C)CCNC(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=NCC[N+]1(C)CCNC(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C39H77N3O/c1-4-6-8-10-12-14-16-18-19-21-22-24-26-28-30-32-38-40-34-36-42(38,3)37-35-41-39(43)33-31-29-27-25-23-20-17-15-13-11-9-7-5-2/h4-37H2,1-3H3/p+1