Bicarbonate Ion → Pentanoic acid {3-[5-(3,5-dichloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-3-yl]-phenyl}-amide
Reaction equation
[C:31]([CH2:32][CH2:33][CH2:34][CH3:35])(=[O:36])[Cl:37].[C:38](=[O:39])([O-:40])[OH:41].[CH3:48][CH2:49][O:50][C:51](=[O:52])[CH3:53].[Cl:1][c:2]1[cH:3][c:4]([C:9]2([C:21]([F:22])([F:23])[F:24])[CH2:10][C:11]([c:14]3[cH:15][c:16]([NH2:20])[cH:17][cH:18][cH:19]3)=[N:12][O:13]2)[cH:5][c:6]([Cl:8])[cH:7]1.[Na+:42].[O:43]1[CH2:44][CH2:45][CH2:46][CH2:47]1.[cH:25]1[cH:26][cH:27][n:28][cH:29][cH:30]1>>[Cl:1][c:2]1[cH:3][c:4]([C:9]2([C:21]([F:22])([F:23])[F:24])[CH2:10][C:11]([c:14]3[cH:15][c:16]([NH:20][C:31]([CH2:32][CH2:33][CH2:34][CH3:35])=[O:36])[cH:17][cH:18][cH:19]3)=[N:12][O:13]2)[cH:5][c:6]([Cl:8])[cH:7]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-7bdc734d17aa4aa4bd8e056bfe7d74c7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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