Acetic Acid → 3-[[3-(4-Chloro-3-ethylphenoxy)phenyl][3-cyclohexylmethyl]amino]-1,1,1-trifluoro-2-propanol
Reaction equation
[C:33]([O:34][BH-:35]([O:36][C:37](=[O:38])[CH3:39])[O:40][C:41](=[O:42])[CH3:43])(=[O:44])[CH3:45].[CH3:47][C:48](=[O:49])[OH:50].[CH:25]1([CH:31]=[O:32])[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30]1.[Cl:1][c:2]1[c:3]([CH2:23][CH3:24])[cH:4][c:5]([O:6][c:7]2[cH:8][c:9]([NH:13][CH2:14][CH:15]([C:16]([F:17])([F:18])[F:19])[OH:20])[cH:10][cH:11][cH:12]2)[cH:21][cH:22]1.[Na+:46].[O:51]1[CH2:52][CH2:53][CH2:54][CH2:55]1>>[Cl:1][c:2]1[c:3]([CH2:23][CH3:24])[cH:4][c:5]([O:6][c:7]2[cH:8][c:9]([N:13]([CH2:14][CH:15]([C:16]([F:17])([F:18])[F:19])[OH:20])[CH2:31][CH:25]3[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30]3)[cH:10][cH:11][cH:12]2)[cH:21][cH:22]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-4b973ab8f55e497e82b04e4cef1ddf81
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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