2-[1-(1-cyanoethyl)-2-undecyl-imidazol-1-ium-1-yl]propanenitrile

Systemtic Name: 2-[1-(1-cyanoethyl)-2-undecyl-imidazol-1-ium-1-yl]propanenitrile Openeye Name: 2-[1-(1-cyanoethyl)-2-undecyl-imidazol-1-ium-1-yl]propanenitrile CAS Name: 2-[1-(1-cyanoethyl)-2-undecyl-1-imidazol-1-iumyl]propanenitrile IUPAC Name: 2-[1-(1-cyanoethyl)-2-undecylimidazol-1-ium-1-yl]propanenitrile Traditional Name: 2-[1-(1-cyanoethyl)-2-undecyl-imidazol-1-ium-1-yl]propionitrile Formula: C20H33N4+ MolecularWeight: 329.50282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=NC=C[N+]1(C(C)C#N)C(C)C#N

Isomeric SMILES

CCCCCCCCCCCC1=NC=C[N+]1(C(C)C#N)C(C)C#N

InChI

InChI=1S/C20H33N4/c1-4-5-6-7-8-9-10-11-12-13-20-23-14-15-24(20,18(2)16-21)19(3)17-22/h14-15,18-19H,4-13H2,1-3H3/q+1