N-(2-cyanoethyl)-N-[2-(1-ethyl-2-nonadecyl-4,5-dihydroimidazol-1-ium-1-yl)ethyl]icosanamide

Systemtic Name: N-(2-cyanoethyl)-N-[2-(1-ethyl-2-nonadecyl-4,5-dihydroimidazol-1-ium-1-yl)ethyl]icosanamide Openeye Name: N-(2-cyanoethyl)-N-[2-(1-ethyl-2-nonadecyl-4,5-dihydroimidazol-1-ium-1-yl)ethyl]icosanamide CAS Name: N-(2-cyanoethyl)-N-[2-(1-ethyl-2-nonadecyl-4,5-dihydroimidazol-1-ium-1-yl)ethyl]eicosanamide IUPAC Name: N-(2-cyanoethyl)-N-[2-(1-ethyl-2-nonadecyl-4,5-dihydroimidazol-1-ium-1-yl)ethyl]icosanamide Traditional Name: N-(2-cyanoethyl)-N-[2-(1-ethyl-2-nonadecyl-2-imidazolin-1-ium-1-yl)ethyl]arachidamide Formula: C49H95N4O+ MolecularWeight: 756.3048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC1=NCC[N+]1(CC)CCN(CCC#N)C(=O)CCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC1=NCC[N+]1(CC)CCN(CCC#N)C(=O)CCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C49H95N4O/c1-4-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-40-48-51-43-46-53(48,6-3)47-45-52(44-39-42-50)49(54)41-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-5-2/h4-41,43-47H2,1-3H3/q+1