(4-cyanophenyl) 1-methylpyridin-1-ium-4-carboxylate

Systemtic Name: (4-cyanophenyl) 1-methylpyridin-1-ium-4-carboxylate Openeye Name: (4-cyanophenyl) 1-methylpyridin-1-ium-4-carboxylate CAS Name: 1-methyl-4-pyridin-1-iumcarboxylic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 1-methylpyridin-1-ium-4-carboxylate Traditional Name: 1-methylpyridin-1-ium-4-carboxylic acid (4-cyanophenyl) ester Formula: C14H11N2O2+ MolecularWeight: 239.24934

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C#N

Isomeric SMILES

C[N+]1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C#N

InChI

InChI=1S/C14H11N2O2/c1-16-8-6-12(7-9-16)14(17)18-13-4-2-11(10-15)3-5-13/h2-9H,1H3/q+1