Ammonia → 3-(4-Hydroxymethylphenyl)propynoic acid-(4'-chlorobiphenyl-4-yl)methylamide
Reaction equation
[CH3:30][OH:31].[Cl:10][c:11]1[cH:12][cH:13][c:14](-[c:17]2[cH:18][cH:19][c:20]([CH2:23][NH:24][C:25]([C:26]#[CH:27])=[O:28])[cH:21][cH:22]2)[cH:15][cH:16]1.[Cl:32][CH2:33][Cl:34].[I:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][OH:7])[cH:8][cH:9]1.[NH3:29]>>[c:2]1([C:27]#[C:26][C:25]([NH:24][CH2:23][c:20]2[cH:19][cH:18][c:17](-[c:14]3[cH:13][cH:12][c:11]([Cl:10])[cH:16][cH:15]3)[cH:22][cH:21]2)=[O:28])[cH:3][cH:4][c:5]([CH2:6][OH:7])[cH:8][cH:9]1Participants
6
Sources & evidence
- ORD record
- ord-f5dc5972881c4cebbdf31a1171f96e41
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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