Water → (2-Ethyl-6-trifluoromethyl-1,2,3,4-tetrahydro-quinolin-4-yl)-carbamic acid benzyl ester
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([NH:10][CH:11]=[CH2:12])=[O:13].[CH3:14][c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1.[CH3:56][CH2:57][O:58][C:59](=[O:60])[CH3:61].[OH2:44].[c:45]1([CH3:46])[cH:47][cH:48][c:49]([S:50]([OH:51])(=[O:52])=[O:53])[cH:54][cH:55]1.[n:21]1([CH:30]([CH2:31][CH3:32])[NH:33][c:34]2[cH:35][cH:36][c:37]([C:40]([F:41])([F:42])[F:43])[cH:38][cH:39]2)[c:22]2[cH:23][cH:24][cH:25][cH:26][c:27]2[n:28][n:29]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([NH:10][CH:11]1[CH2:12][CH:30]([CH2:31][CH3:32])[NH:33][c:34]2[c:35]1[cH:36][c:37]([C:40]([F:41])([F:42])[F:43])[cH:38][cH:39]2)=[O:13]Participants
7
Sources & evidence
- ORD record
- ord-e6549271ad4f4f77b5a73e65d6b7dc5a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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