ethyl (3S)-1-[(6-chloranylpyridin-3-yl)methyl]piperidin-1-ium-3-carboxylate

Systemtic Name: ethyl (3S)-1-[(6-chloranylpyridin-3-yl)methyl]piperidin-1-ium-3-carboxylate Openeye Name: ethyl (3S)-1-[(6-chloro-3-pyridyl)methyl]piperidin-1-ium-3-carboxylate CAS Name: (3S)-1-[(6-chloro-3-pyridinyl)methyl]-3-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[(6-chloropyridin-3-yl)methyl]piperidin-1-ium-3-carboxylate Traditional Name: (3S)-1-[(6-chloro-3-pyridyl)methyl]piperidin-1-ium-3-carboxylic acid ethyl ester Formula: C14H20ClN2O2+ MolecularWeight: 283.7738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC[NH+](C1)CC2=CN=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)[C@H]1CCC[NH+](C1)CC2=CN=C(C=C2)Cl

InChI

InChI=1S/C14H19ClN2O2/c1-2-19-14(18)12-4-3-7-17(10-12)9-11-5-6-13(15)16-8-11/h5-6,8,12H,2-4,7,9-10H2,1H3/p+1/t12-/m0/s1