N-(5-chloranyl-2-cyano-phenyl)-2-[4-(phenylmethyl)pyridin-1-ium-1-yl]ethanamide

Systemtic Name: N-(5-chloranyl-2-cyano-phenyl)-2-[4-(phenylmethyl)pyridin-1-ium-1-yl]ethanamide Openeye Name: 2-(4-benzylpyridin-1-ium-1-yl)-N-(5-chloro-2-cyano-phenyl)acetamide CAS Name: N-(5-chloro-2-cyanophenyl)-2-[4-(phenylmethyl)-1-pyridin-1-iumyl]acetamide IUPAC Name: 2-(4-benzylpyridin-1-ium-1-yl)-N-(5-chloro-2-cyanophenyl)acetamide Traditional Name: 2-(4-benzylpyridin-1-ium-1-yl)-N-(5-chloro-2-cyano-phenyl)acetamide Formula: C21H17ClN3O+ MolecularWeight: 362.83218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=[N+](C=C2)CC(=O)NC3=C(C=CC(=C3)Cl)C#N

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=[N+](C=C2)CC(=O)NC3=C(C=CC(=C3)Cl)C#N

InChI

InChI=1S/C21H16ClN3O/c22-19-7-6-18(14-23)20(13-19)24-21(26)15-25-10-8-17(9-11-25)12-16-4-2-1-3-5-16/h1-11,13H,12,15H2/p+1