ethyl 1-phenacylpyridin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-phenacylpyridin-1-ium-4-carboxylate Openeye Name: ethyl 1-phenacylpyridin-1-ium-4-carboxylate CAS Name: 1-phenacyl-4-pyridin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-phenacylpyridin-1-ium-4-carboxylate Traditional Name: 1-phenacylpyridin-1-ium-4-carboxylic acid ethyl ester Formula: C16H16NO3+ MolecularWeight: 270.30314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16NO3/c1-2-20-16(19)14-8-10-17(11-9-14)12-15(18)13-6-4-3-5-7-13/h3-11H,2,12H2,1H3/q+1