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

Systemtic Name: N-(2-adamantylmethyl)-6-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-2-oxidanylidene-1H-pyridine-3-carboxamide Openeye Name: N-(2-adamantylmethyl)-6-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide CAS Name: N-(2-adamantylmethyl)-6-[[(2S)-2-methyl-1-piperidin-1-iumyl]methyl]-2-oxo-1H-pyridine-3-carboxamide IUPAC Name: N-(2-adamantylmethyl)-6-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide Traditional Name: N-(2-adamantylmethyl)-2-keto-6-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-1H-pyridine-3-carboxamide Formula: C24H36N3O2+ MolecularWeight: 398.56154

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC2=CC=C(C(=O)N2)C(=O)NCC3C4CC5CC(C4)CC3C5

Isomeric SMILES

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

InChI

InChI=1S/C24H35N3O2/c1-15-4-2-3-7-27(15)14-20-5-6-21(24(29)26-20)23(28)25-13-22-18-9-16-8-17(11-18)12-19(22)10-16/h5-6,15-19,22H,2-4,7-14H2,1H3,(H,25,28)(H,26,29)/p+1/t15-,16?,17?,18?,19?,22?/m0/s1