methyl 2-(3-phenylpyridin-1-ium-1-yl)ethanoate

Systemtic Name: methyl 2-(3-phenylpyridin-1-ium-1-yl)ethanoate Openeye Name: methyl 2-(3-phenylpyridin-1-ium-1-yl)acetate CAS Name: 2-(3-phenyl-1-pyridin-1-iumyl)acetic acid methyl ester IUPAC Name: methyl 2-(3-phenylpyridin-1-ium-1-yl)acetate Traditional Name: 2-(3-phenylpyridin-1-ium-1-yl)acetic acid methyl ester Formula: C14H14NO2+ MolecularWeight: 228.26646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14NO2/c1-17-14(16)11-15-9-5-8-13(10-15)12-6-3-2-4-7-12/h2-10H,11H2,1H3/q+1