3-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-8-methyl-imidazo[1,2-a]pyridine-2-carboxylate

Systemtic Name: 3-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-8-methyl-imidazo[1,2-a]pyridine-2-carboxylate Openeye Name: 3-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-8-methyl-imidazo[1,2-a]pyridine-2-carboxylate CAS Name: 3-[[(2S)-2-ethyl-1-piperidin-1-iumyl]methyl]-8-methyl-2-imidazo[1,2-a]pyridinecarboxylate IUPAC Name: 3-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-8-methylimidazo[1,2-a]pyridine-2-carboxylate Traditional Name: 3-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-8-methyl-imidazo[1,2-a]pyridine-2-carboxylate Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC2=C(N=C3N2C=CC=C3C)C(=O)[O-]

Isomeric SMILES

CC[C@H]1CCCC[NH+]1CC2=C(N=C3N2C=CC=C3C)C(=O)[O-]

InChI

InChI=1S/C17H23N3O2/c1-3-13-8-4-5-9-19(13)11-14-15(17(21)22)18-16-12(2)7-6-10-20(14)16/h6-7,10,13H,3-5,8-9,11H2,1-2H3,(H,21,22)/t13-/m0/s1