Dichloromethane → 3-({4-[3-(3-Chlorophenyl)-4-(3,4-dimethylphenyl)but-1-yn-1-yl]benzyl}amino)propanoic acid
Reaction equation
[Cl:1][c:2]1[cH:3][c:4]([CH:8]([C:9]#[C:10][c:11]2[cH:12][cH:13][c:14]([CH2:15][NH:16][CH2:17][CH2:18][C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[cH:26][cH:27]2)[CH2:28][c:29]2[cH:30][c:31]([CH3:36])[c:32]([CH3:35])[cH:33][cH:34]2)[cH:5][cH:6][cH:7]1.[Cl:44][CH2:45][Cl:46].[F:37][C:38]([F:39])([F:40])[C:41]([OH:42])=[O:43]>>[Cl:1][c:2]1[cH:3][c:4]([CH:8]([C:9]#[C:10][c:11]2[cH:12][cH:13][c:14]([CH2:15][NH:16][CH2:17][CH2:18][C:19](=[O:20])[OH:21])[cH:26][cH:27]2)[CH2:28][c:29]2[cH:30][c:31]([CH3:36])[c:32]([CH3:35])[cH:33][cH:34]2)[cH:5][cH:6][cH:7]1Participants
4
Sources & evidence
- ORD record
- ord-a03aaf721b33476b9f1ad9c12542ba16
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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