N-(cyanomethyl)-N-(4-methylphenyl)-2-pyridin-1-ium-1-yl-ethanamide

Systemtic Name: N-(cyanomethyl)-N-(4-methylphenyl)-2-pyridin-1-ium-1-yl-ethanamide Openeye Name: N-(cyanomethyl)-N-(p-tolyl)-2-pyridin-1-ium-1-yl-acetamide CAS Name: N-(cyanomethyl)-N-(4-methylphenyl)-2-(1-pyridin-1-iumyl)acetamide IUPAC Name: N-(cyanomethyl)-N-(4-methylphenyl)-2-pyridin-1-ium-1-ylacetamide Traditional Name: N-(cyanomethyl)-N-(p-tolyl)-2-pyridin-1-ium-1-yl-acetamide Formula: C16H16N3O+ MolecularWeight: 266.31774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC#N)C(=O)C[N+]2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)N(CC#N)C(=O)C[N+]2=CC=CC=C2

InChI

InChI=1S/C16H16N3O/c1-14-5-7-15(8-6-14)19(12-9-17)16(20)13-18-10-3-2-4-11-18/h2-8,10-11H,12-13H2,1H3/q+1