Toluene → Ethyl 3-[4-({[4'-(2-ethoxyethoxy)-2',6'-dimethylbiphenyl-3-yl]methyl}amino)phenyl]-2-fluoropropanoate
Reaction equation
[CH2:16]([CH3:17])[O:18][CH2:19][CH2:20][O:21][c:22]1[cH:23][c:24]([CH3:37])[c:25](-[c:29]2[cH:30][c:31]([CH:35]=[O:36])[cH:32][cH:33][cH:34]2)[c:26]([CH3:28])[cH:27]1.[CH3:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1.[NH2:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][CH:9]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[F:15])[cH:6][cH:7]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([CH2:8][CH:9]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[F:15])[cH:6][cH:7]1)[CH2:35][c:31]1[cH:30][c:29](-[c:25]2[c:24]([CH3:37])[cH:23][c:22]([O:21][CH2:20][CH2:19][O:18][CH2:16][CH3:17])[cH:27][c:26]2[CH3:28])[cH:34][cH:33][cH:32]1Participants
4
Sources & evidence
- ORD record
- ord-6980500be633473eb0bb20b593b4bac1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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