N-(2-adamantylmethyl)-6-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-oxidanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-(2-adamantylmethyl)-6-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-oxidanylidene-1H-pyridine-3-carboxamide Openeye Name: N-(2-adamantylmethyl)-6-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide CAS Name: N-(2-adamantylmethyl)-6-[[(2S)-2-ethyl-1-piperidin-1-iumyl]methyl]-2-oxo-1H-pyridine-3-carboxamide IUPAC Name: N-(2-adamantylmethyl)-6-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide Traditional Name: N-(2-adamantylmethyl)-6-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-keto-1H-pyridine-3-carboxamide Formula: C25H38N3O2+ MolecularWeight: 412.58812

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC2=CC=C(C(=O)N2)C(=O)NCC3C4CC5CC(C4)CC3C5

Isomeric SMILES

CC[C@H]1CCCC[NH+]1CC2=CC=C(C(=O)N2)C(=O)NCC3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C25H37N3O2/c1-2-21-5-3-4-8-28(21)15-20-6-7-22(25(30)27-20)24(29)26-14-23-18-10-16-9-17(12-18)13-19(23)11-16/h6-7,16-19,21,23H,2-5,8-15H2,1H3,(H,26,29)(H,27,30)/p+1/t16?,17?,18?,19?,21-,23?/m0/s1