Bicarbonate Ion → 6-[2-(2-Chloro-5-hydroxy-phenyl)-1-hydroxy-1-trifluoromethyl-propyl]-4-methyl-4H-benzo[1,4]oxazin-3-one
Reaction equation
[B:30]([Br:31])([Br:32])[Br:33].[Cl:1][c:2]1[c:3]([CH:10]([C:11]([C:12]([F:13])([F:14])[F:15])([OH:16])[c:17]2[cH:18][cH:19][c:20]3[c:21]([cH:28]2)[N:22]([CH3:27])[C:23](=[O:26])[CH2:24][O:25]3)[CH3:29])[cH:4][c:5]([O:8][CH3:9])[cH:6][cH:7]1.[Cl:40][CH2:41][Cl:42].[Na+:39].[O-:35][C:36]([OH:37])=[O:38].[OH2:34]>>[Cl:1][c:2]1[c:3]([CH:10]([C:11]([C:12]([F:13])([F:14])[F:15])([OH:16])[c:17]2[cH:18][cH:19][c:20]3[c:21]([cH:28]2)[N:22]([CH3:27])[C:23](=[O:26])[CH2:24][O:25]3)[CH3:29])[cH:4][c:5]([OH:8])[cH:6][cH:7]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-7fe5a4bc415c47a9b7d443b078a0662c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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