2-(2-chlorophenyl)-1-ethyl-imidazol-1-ium-2-carbonitrile

Systemtic Name: 2-(2-chlorophenyl)-1-ethyl-imidazol-1-ium-2-carbonitrile Openeye Name: 2-(2-chlorophenyl)-1-ethyl-imidazol-1-ium-2-carbonitrile CAS Name: 2-(2-chlorophenyl)-1-ethyl-2-imidazol-1-iumcarbonitrile IUPAC Name: 2-(2-chlorophenyl)-1-ethylimidazol-1-ium-2-carbonitrile Traditional Name: 2-(2-chlorophenyl)-1-ethyl-imidazol-1-ium-2-carbonitrile Formula: C12H11ClN3+ MolecularWeight: 232.68884

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=NC1(C#N)C2=CC=CC=C2Cl

Isomeric SMILES

CC[N+]1=CC=NC1(C#N)C2=CC=CC=C2Cl

InChI

InChI=1S/C12H11ClN3/c1-2-16-8-7-15-12(16,9-14)10-5-3-4-6-11(10)13/h3-8H,2H2,1H3/q+1