Methanol → 3-[4-[4-(N-acetyl-4-chloroanilino)-2-methyl-3,4-dihydro-2H-quinoline-1-carbonyl]phenyl]prop-2-enoic acid
Reaction equation
[CH2:49]1[O:50][CH2:51][CH2:52][CH2:53]1.[CH3:11][O:12][C:13]([CH:14]=[CH:15][c:16]1[cH:17][cH:18][c:19]([C:22](=[O:23])[N:24]2[CH:25]([CH3:45])[CH2:26][CH:27]([N:34]([c:35]3[cH:36][cH:37][c:38]([Cl:41])[cH:39][cH:40]3)[C:42]([CH3:43])=[O:44])[c:28]3[cH:29][cH:30][cH:31][cH:32][c:33]32)[cH:20][cH:21]1)=[O:46].[CH3:54][OH:55].[F:1][c:2]1[cH:3][cH:4][c:5]([C:6]([Cl:7])=[O:8])[cH:9][cH:10]1.[Li+:48].[OH-:47]>>[O:12]=[C:13]([CH:14]=[CH:15][c:16]1[cH:17][cH:18][c:19]([C:22](=[O:23])[N:24]2[CH:25]([CH3:45])[CH2:26][CH:27]([N:34]([c:35]3[cH:36][cH:37][c:38]([Cl:41])[cH:39][cH:40]3)[C:42]([CH3:43])=[O:44])[c:28]3[cH:29][cH:30][cH:31][cH:32][c:33]32)[cH:20][cH:21]1)[OH:46]Participants
7
Sources & evidence
- ORD record
- ord-727aa533b4754e809f2e6bbb0c22d79d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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