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

Systemtic Name: N-[2-[2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]ethyl]octadecanamide Openeye Name: N-[2-[2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]ethyl]octadecanamide CAS Name: N-[2-[2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]ethyl]octadecanamide IUPAC Name: N-[2-[2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]ethyl]octadecanamide Traditional Name: N-[2-[2-heptadecyl-1-(2-hydroxyethyl)-2-imidazolin-1-ium-1-yl]ethyl]stearamide Formula: C42H84N3O2+ MolecularWeight: 663.13526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=NCC[N+]1(CCNC(=O)CCCCCCCCCCCCCCCCC)CCO

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=NCC[N+]1(CCNC(=O)CCCCCCCCCCCCCCCCC)CCO

InChI

InChI=1S/C42H83N3O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41-43-35-37-45(41,39-40-46)38-36-44-42(47)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h46H,3-40H2,1-2H3/p+1