3-(Trifluoromethyl)benzoyl chloride → HCID 22660194, compound
Reaction equation
[CH3:1][O:2][C:3]([CH:4]([NH:5][C:6](=[O:7])[C:8]1([CH2:13][CH2:14][NH2:15])[CH2:9][CH2:10][CH2:11][CH2:12]1)[CH2:16][c:17]1[cH:18][cH:19][c:20]([NH:23][C:24](=[O:25])[c:26]2[c:27]([Cl:33])[cH:28][cH:29][cH:30][c:31]2[Cl:32])[cH:21][cH:22]1)=[O:34].[F:35][C:36]([c:37]1[cH:38][c:39]([C:40](=[O:41])[Cl:42])[cH:43][cH:44][cH:45]1)([F:46])[F:47]>>[CH3:1][O:2][C:3]([CH:4]([NH:5][C:6](=[O:7])[C:8]1([CH2:13][CH2:14][NH:15][C:40]([c:39]2[cH:38][c:37]([C:36]([F:35])([F:46])[F:47])[cH:45][cH:44][cH:43]2)=[O:41])[CH2:9][CH2:10][CH2:11][CH2:12]1)[CH2:16][c:17]1[cH:18][cH:19][c:20]([NH:23][C:24](=[O:25])[c:26]2[c:27]([Cl:33])[cH:28][cH:29][cH:30][c:31]2[Cl:32])[cH:21][cH:22]1)=[O:34]Participants
3
Sources & evidence
- ORD record
- ord-2cd3e5c720df43048cbea642b4ab02b5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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