N-(5-chloranyl-2-cyano-phenyl)-2-(3-ethanoylpyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-(5-chloranyl-2-cyano-phenyl)-2-(3-ethanoylpyridin-1-ium-1-yl)ethanamide Openeye Name: 2-(3-acetylpyridin-1-ium-1-yl)-N-(5-chloro-2-cyano-phenyl)acetamide CAS Name: 2-(3-acetyl-1-pyridin-1-iumyl)-N-(5-chloro-2-cyanophenyl)acetamide IUPAC Name: 2-(3-acetylpyridin-1-ium-1-yl)-N-(5-chloro-2-cyanophenyl)acetamide Traditional Name: 2-(3-acetylpyridin-1-ium-1-yl)-N-(5-chloro-2-cyano-phenyl)acetamide Formula: C16H13ClN3O2+ MolecularWeight: 314.74632

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C[N+](=CC=C1)CC(=O)NC2=C(C=CC(=C2)Cl)C#N

Isomeric SMILES

CC(=O)C1=C[N+](=CC=C1)CC(=O)NC2=C(C=CC(=C2)Cl)C#N

InChI

InChI=1S/C16H12ClN3O2/c1-11(21)13-3-2-6-20(9-13)10-16(22)19-15-7-14(17)5-4-12(15)8-18/h2-7,9H,10H2,1H3/p+1