1-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxylate

Systemtic Name: 1-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxylate Openeye Name: 1-(3-pyridylmethyl)piperidin-1-ium-4-carboxylate CAS Name: 1-(3-pyridinylmethyl)-4-piperidin-1-iumcarboxylate IUPAC Name: 1-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxylate Traditional Name: 1-(3-pyridylmethyl)piperidin-1-ium-4-carboxylate Formula: C12H16N2O2 MolecularWeight: 220.26764

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)[O-])CC2=CN=CC=C2

Isomeric SMILES

C1C[NH+](CCC1C(=O)[O-])CC2=CN=CC=C2

InChI

InChI=1S/C12H16N2O2/c15-12(16)11-3-6-14(7-4-11)9-10-2-1-5-13-8-10/h1-2,5,8,11H,3-4,6-7,9H2,(H,15,16)