ethyl 1-(phenylmethyl)pyridin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-(phenylmethyl)pyridin-1-ium-4-carboxylate Openeye Name: ethyl 1-benzylpyridin-1-ium-4-carboxylate CAS Name: 1-(phenylmethyl)-4-pyridin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzylpyridin-1-ium-4-carboxylate Traditional Name: 1-benzylpyridin-1-ium-4-carboxylic acid ethyl ester Formula: C15H16NO2+ MolecularWeight: 242.29304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=[N+](C=C1)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CC=[N+](C=C1)CC2=CC=CC=C2

InChI

InChI=1S/C15H16NO2/c1-2-18-15(17)14-8-10-16(11-9-14)12-13-6-4-3-5-7-13/h3-11H,2,12H2,1H3/q+1