Benzene → 3-amino-4-(2-chlorophenyl)-1,6,7-trimethyl-2(1H)-quinolone
Reaction equation
[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[Cl:8][c:9]1[c:10](-[c:15]2[c:16]([C:29]([OH:30])=[O:31])[c:17](=[O:28])[n:18]([CH3:27])[c:19]3[cH:20][c:21]([CH3:26])[c:22]([CH3:25])[cH:23][c:24]23)[cH:11][cH:12][cH:13][cH:14]1.[c:32]1([P:33]([N:34]=[N+:35]=[N-:36])([c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)=[O:43])[cH:44][cH:45][cH:46][cH:47][cH:48]1.[cH:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1>>[NH2:3][c:16]1[c:15](-[c:10]2[c:9]([Cl:8])[cH:14][cH:13][cH:12][cH:11]2)[c:24]2[c:19]([n:18]([CH3:27])[c:17]1=[O:28])[cH:20][c:21]([CH3:26])[c:22]([CH3:25])[cH:23]2Participants
5
Sources & evidence
- ORD record
- ord-9d65b1d6f8ee4892945a7ac6b96a5061
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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