Acetic Acid → 2-Chloro-4-(7-hydroxy-7a-methyl-3-oxo-1,5,6,7-tetrahydropyrrolo[1,2-c]imidazol-2-yl)-3-methylbenzonitrile
Reaction equation
[C:1]([Si:2]([CH3:3])([CH3:4])[O:6][CH:7]1[CH2:8][CH2:9][N:10]2[C:11](=[O:26])[N:12]([c:16]3[c:17]([CH3:25])[c:18]([Cl:24])[c:19]([C:20]#[N:21])[cH:22][cH:23]3)[CH2:13][C:14]12[CH3:15])([CH3:5])([CH3:27])[CH3:28].[CH2:34]([N+:35]([CH2:36][CH2:37][CH2:38][CH3:39])([CH2:40][CH2:41][CH2:42][CH3:43])[CH2:44][CH2:45][CH2:46][CH3:47])[CH2:48][CH2:49][CH3:50].[CH2:51]1[O:52][CH2:53][CH2:54][CH2:55]1.[CH3:29][C:30](=[O:31])[OH:32].[F-:33]>>[OH:6][CH:7]1[CH2:8][CH2:9][N:10]2[C:11](=[O:26])[N:12]([c:16]3[c:17]([CH3:25])[c:18]([Cl:24])[c:19]([C:20]#[N:21])[cH:22][cH:23]3)[CH2:13][C:14]12[CH3:15]Participants
6
Sources & evidence
- ORD record
- ord-9ccb15599ff4466c8ca81adeef35ee28
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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