phenyl 2-(1-methylpyridin-1-ium-4-yl)ethanoate

Systemtic Name: phenyl 2-(1-methylpyridin-1-ium-4-yl)ethanoate Openeye Name: phenyl 2-(1-methylpyridin-1-ium-4-yl)acetate CAS Name: 2-(1-methyl-4-pyridin-1-iumyl)acetic acid phenyl ester IUPAC Name: phenyl 2-(1-methylpyridin-1-ium-4-yl)acetate Traditional Name: 2-(1-methylpyridin-1-ium-4-yl)acetic acid phenyl ester Formula: C14H14NO2+ MolecularWeight: 228.26646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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