ethyl 2-[(2S)-2-pyridin-3-ylpiperidin-1-ium-1-yl]ethanoate

Systemtic Name: ethyl 2-[(2S)-2-pyridin-3-ylpiperidin-1-ium-1-yl]ethanoate Openeye Name: ethyl 2-[(2S)-2-(3-pyridyl)piperidin-1-ium-1-yl]acetate CAS Name: 2-[(2S)-2-(3-pyridinyl)-1-piperidin-1-iumyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2S)-2-pyridin-3-ylpiperidin-1-ium-1-yl]acetate Traditional Name: 2-[(2S)-2-(3-pyridyl)piperidin-1-ium-1-yl]acetic acid ethyl ester Formula: C14H21N2O2+ MolecularWeight: 249.32874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[NH+]1CCCCC1C2=CN=CC=C2

Isomeric SMILES

CCOC(=O)C[NH+]1CCCC[C@H]1C2=CN=CC=C2

InChI

InChI=1S/C14H20N2O2/c1-2-18-14(17)11-16-9-4-3-7-13(16)12-6-5-8-15-10-12/h5-6,8,10,13H,2-4,7,9,11H2,1H3/p+1/t13-/m0/s1