Ethanol → 3-[4-(1,1-Dimethylheptyl)-2-hydroxyphenyl]-1-N-(2-propenyl)-1,2,5,6-tetrahydropyridine
Reaction equation
[C:23](=[O:24])([O-:25])[O-:26].[CH2:29]([Br:30])[CH:31]=[CH2:32].[CH3:1][C:2]([c:3]1[cH:4][cH:5][c:6]([C:7]2=[CH:12][CH2:11][CH2:10][NH:9][CH2:8]2)[c:13]([OH:14])[cH:15]1)([CH3:16])[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH3:22].[CH3:33][C:34]([CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH3:40])([CH3:41])[c:42]1[cH:43][c:44]([O:57][CH2:58][CH:59]=[CH2:60])[c:45]([C:48]2=[CH:53][CH2:52][CH2:51][N:50]([CH2:54][CH:55]=[CH2:56])[CH2:49]2)[cH:46][cH:47]1.[CH3:61][CH2:62][OH:63].[K+:27].[K+:28]>>[CH3:33][C:34]([CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH3:40])([CH3:41])[c:42]1[cH:43][c:44]([OH:57])[c:45]([C:48]2=[CH:53][CH2:52][CH2:51][N:50]([CH2:54][CH:55]=[CH2:56])[CH2:49]2)[cH:46][cH:47]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-62d60ef383c04b5c99e0e3b4d484d4d9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
Loading…