ethyl 1-[(6-chloranylpyridin-3-yl)methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[(6-chloranylpyridin-3-yl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[(6-chloro-3-pyridyl)methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(6-chloro-3-pyridinyl)methyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(6-chloropyridin-3-yl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[(6-chloro-3-pyridyl)methyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C14H20ClN2O2+ MolecularWeight: 283.7738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CC2=CN=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CC2=CN=C(C=C2)Cl

InChI

InChI=1S/C14H19ClN2O2/c1-2-19-14(18)12-5-7-17(8-6-12)10-11-3-4-13(15)16-9-11/h3-4,9,12H,2,5-8,10H2,1H3/p+1