ethyl 1-pyridin-1-ium-2-ylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-pyridin-1-ium-2-ylpiperidine-4-carboxylate Openeye Name: ethyl 1-pyridin-1-ium-2-ylpiperidine-4-carboxylate CAS Name: 1-(2-pyridin-1-iumyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-pyridin-1-ium-2-ylpiperidine-4-carboxylate Traditional Name: 1-pyridin-1-ium-2-ylisonipecotic acid ethyl ester Formula: C13H19N2O2+ MolecularWeight: 235.30216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=CC=CC=[NH+]2

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=CC=CC=[NH+]2

InChI

InChI=1S/C13H18N2O2/c1-2-17-13(16)11-6-9-15(10-7-11)12-5-3-4-8-14-12/h3-5,8,11H,2,6-7,9-10H2,1H3/p+1