Ethanol → Methyl [3,5-bis(trifluoromethyl)benzyl][2-isoquinolin-4-yl-5-(trifluoromethyl)benzyl]carbamate
Reaction equation
[CH3:33][CH2:34][OH:35].[CH3:55][c:56]1[cH:57][cH:58][cH:59][cH:60][cH:61]1.[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][N:7]([C:8]([O:9][CH3:10])=[O:11])[CH2:12][c:13]2[c:14]([I:23])[cH:15][cH:16][c:17]([C:19]([F:20])([F:21])[F:22])[cH:18]2)[cH:24][c:25]([C:27]([F:28])([F:29])[F:30])[cH:26]1)([F:31])[F:32].[Na+:49].[Na+:50].[O-:51][C:52](=[O:53])[O-:54].[cH:36]1[n:37][cH:38][c:39]([B:46]([OH:47])[OH:48])[c:40]2[cH:41][cH:42][cH:43][cH:44][c:45]12>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][N:7]([C:8]([O:9][CH3:10])=[O:11])[CH2:12][c:13]2[c:14](-[c:39]3[cH:38][n:37][cH:36][c:45]4[c:40]3[cH:41][cH:42][cH:43][cH:44]4)[cH:15][cH:16][c:17]([C:19]([F:20])([F:21])[F:22])[cH:18]2)[cH:24][c:25]([C:27]([F:28])([F:29])[F:30])[cH:26]1)([F:31])[F:32]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-17024ee8aaf84b5aab277a609f4219f0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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