6-[[(3S)-3-(diethylcarbamoyl)piperidin-1-ium-1-yl]methyl]-N-[(1-oxidanylcyclohexyl)methyl]-2-oxidanylidene-1H-pyridine-3-carboxamide

Systemtic Name: 6-[[(3S)-3-(diethylcarbamoyl)piperidin-1-ium-1-yl]methyl]-N-[(1-oxidanylcyclohexyl)methyl]-2-oxidanylidene-1H-pyridine-3-carboxamide Openeye Name: 6-[[(3S)-3-(diethylcarbamoyl)piperidin-1-ium-1-yl]methyl]-N-[(1-hydroxycyclohexyl)methyl]-2-oxo-1H-pyridine-3-carboxamide CAS Name: 6-[[(3S)-3-[diethylamino(oxo)methyl]-1-piperidin-1-iumyl]methyl]-N-[(1-hydroxycyclohexyl)methyl]-2-oxo-1H-pyridine-3-carboxamide IUPAC Name: 6-[[(3S)-3-(diethylcarbamoyl)piperidin-1-ium-1-yl]methyl]-N-[(1-hydroxycyclohexyl)methyl]-2-oxo-1H-pyridine-3-carboxamide Traditional Name: 6-[[(3S)-3-(diethylcarbamoyl)piperidin-1-ium-1-yl]methyl]-N-[(1-hydroxycyclohexyl)methyl]-2-keto-1H-pyridine-3-carboxamide Formula: C24H39N4O4+ MolecularWeight: 447.59086

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CCC[NH+](C1)CC2=CC=C(C(=O)N2)C(=O)NCC3(CCCCC3)O

Isomeric SMILES

CCN(CC)C(=O)[C@H]1CCC[NH+](C1)CC2=CC=C(C(=O)N2)C(=O)NCC3(CCCCC3)O

InChI

InChI=1S/C24H38N4O4/c1-3-28(4-2)23(31)18-9-8-14-27(15-18)16-19-10-11-20(22(30)26-19)21(29)25-17-24(32)12-6-5-7-13-24/h10-11,18,32H,3-9,12-17H2,1-2H3,(H,25,29)(H,26,30)/p+1/t18-/m0/s1