Dichloromethane → (4-Fluorophenyl) 4-[4-(4-pentylcyclohexyl)butyl]benzoate
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH2:4][CH3:5])[CH:6]1[CH2:7][CH2:8][CH:9]([CH2:12][CH2:13][CH2:14][CH2:15][c:16]2[cH:17][cH:18][c:19]([C:20](=[O:21])[OH:22])[cH:23][cH:24]2)[CH2:10][CH2:11]1.[CH3:48][N:49]([CH3:50])[c:51]1[cH:52][cH:53][n:54][cH:55][cH:56]1.[CH:33]1([N:34]=[C:35]=[N:36][CH:37]2[CH2:38][CH2:39][CH2:40][CH2:41][CH2:42]2)[CH2:43][CH2:44][CH2:45][CH2:46][CH2:47]1.[Cl:57][CH2:58][Cl:59].[F:25][c:26]1[cH:27][cH:28][c:29]([OH:32])[cH:30][cH:31]1>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH3:5])[CH:6]1[CH2:7][CH2:8][CH:9]([CH2:12][CH2:13][CH2:14][CH2:15][c:16]2[cH:17][cH:18][c:19]([C:20]([O:21][c:29]3[cH:28][cH:27][c:26]([F:25])[cH:31][cH:30]3)=[O:22])[cH:23][cH:24]2)[CH2:10][CH2:11]1Participants
6
Sources & evidence
- ORD record
- ord-c101d32bc4334dbf847bbe867756b2a5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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