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Hydrochloric Acid → N-(1-Azabicyclo[2.2.2]octan-3-yl)-2,4-dimethoxybenzamide

HRID 286910
Notes
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Reaction equation

HRID 286910 reaction equation
[CH3:1][O:2][c:3]1[c:4]([C:5](=[O:6])[OH:7])[cH:8][cH:9][c:10]([O:12][CH3:13])[cH:11]1.[CH3:25][NH3+:26].[ClH:14].[ClH:15].[NH2:16][CH:17]1[CH2:18][N:19]2[CH2:20][CH2:21][CH:22]1[CH2:23][CH2:24]2.[Na+:59].[O:60]=[CH:61][N:62]([CH3:63])[CH3:64].[OH-:58].[P-:27]([F:28])([F:29])([F:30])([F:31])([F:32])[F:33].[P-:51]([F:52])([F:53])([F:54])([F:55])([F:56])[F:57].[n:34]1([O:35][C:36]([N:37]([CH3:38])[CH3:39])=[N+:40]([CH3:41])[CH3:42])[c:43]2[n:44][cH:45][cH:46][cH:47][c:48]2[n:49][n:50]1>>[CH3:1][O:2][c:3]1[c:4]([C:5](=[O:7])[NH:16][CH:17]2[CH2:18][N:19]3[CH2:20][CH2:21][CH:22]2[CH2:23][CH2:24]3)[cH:8][cH:9][c:10]([O:12][CH3:13])[cH:11]1
ParticipantsSources & evidenceReaction notes

Participants

10

Reactant 9

HCID 313Hydrochloric Acid2×HCID 923Sodium IonHCID 961HydroxideHCID 6228DimethylformamideHCID 70522,4-Dimethoxybenzoic acidHCID 9886Hexafluorophosphate2×HCID 1232383-Aminoquinuclidine
HCID 644041
Methylammonium
HCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium

Product 1

HCID 13272329N-(1-Azabicyclo[2.2.2]octan-3-yl)-2,4-dimethoxybenzamide

Sources & evidence

ORD record
ord-d8163a5e4c9640a9820ace97ac4eff6e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes