ethyl (3S)-3-(pyridin-2-ylmethyl)piperidin-1-ium-3-carboxylate

Systemtic Name: ethyl (3S)-3-(pyridin-2-ylmethyl)piperidin-1-ium-3-carboxylate Openeye Name: ethyl (3S)-3-(2-pyridylmethyl)piperidin-1-ium-3-carboxylate CAS Name: (3S)-3-(2-pyridinylmethyl)-3-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-3-(pyridin-2-ylmethyl)piperidin-1-ium-3-carboxylate Traditional Name: (3S)-3-(2-pyridylmethyl)piperidin-1-ium-3-carboxylic acid ethyl ester Formula: C14H21N2O2+ MolecularWeight: 249.32874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC[NH2+]C1)CC2=CC=CC=N2

Isomeric SMILES

CCOC(=O)[C@@]1(CCC[NH2+]C1)CC2=CC=CC=N2

InChI

InChI=1S/C14H20N2O2/c1-2-18-13(17)14(7-5-8-15-11-14)10-12-6-3-4-9-16-12/h3-4,6,9,15H,2,5,7-8,10-11H2,1H3/p+1/t14-/m0/s1