6-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-2-oxidanylidene-1H-pyridine-3-carboxamide

Systemtic Name: 6-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-2-oxidanylidene-1H-pyridine-3-carboxamide Openeye Name: 6-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-2-oxo-1H-pyridine-3-carboxamide CAS Name: 6-[[(2S)-2-ethyl-1-piperidin-1-iumyl]methyl]-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-2-oxo-1H-pyridine-3-carboxamide IUPAC Name: 6-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-2-oxo-1H-pyridine-3-carboxamide Traditional Name: 6-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-keto-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-1H-pyridine-3-carboxamide Formula: C25H35N4O2+ MolecularWeight: 423.571

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC2=CC=C(C(=O)N2)C(=O)NCC3=CC4=C(C=C3)N(CCC4)C

Isomeric SMILES

CC[C@H]1CCCC[NH+]1CC2=CC=C(C(=O)N2)C(=O)NCC3=CC4=C(C=C3)N(CCC4)C

InChI

InChI=1S/C25H34N4O2/c1-3-21-8-4-5-14-29(21)17-20-10-11-22(25(31)27-20)24(30)26-16-18-9-12-23-19(15-18)7-6-13-28(23)2/h9-12,15,21H,3-8,13-14,16-17H2,1-2H3,(H,26,30)(H,27,31)/p+1/t21-/m0/s1