Acetonitrile → 4-[4-(Difluoromethyl)phenoxy]-6-(ethoxycarbonyl)-1-benzofuran-2-carboxylic acid
Reaction equation
[CH3:32][C:33]#[N:34].[CH3:35][CH2:36][O:37][C:38](=[O:39])[CH3:40].[F:6][CH:7]([c:8]1[cH:9][cH:10][c:11]([O:12][c:13]2[cH:14][c:15]([C:24](=[O:25])[O:26][CH2:27][CH3:28])[cH:16][c:17]3[c:18]2[cH:19][c:20]([CH:22]=[O:23])[o:21]3)[cH:29][cH:30]1)[F:31].[I+3:1]([O-:2])([OH:3])([O-:4])[O-:5]>>[OH:2][C:22]([c:20]1[cH:19][c:18]2[c:13]([O:12][c:11]3[cH:10][cH:9][c:8]([CH:7]([F:6])[F:31])[cH:30][cH:29]3)[cH:14][c:15]([C:24](=[O:25])[O:26][CH2:27][CH3:28])[cH:16][c:17]2[o:21]1)=[O:23]Participants
5
Sources & evidence
- ORD record
- ord-75d8c075f704471baa65f10150a86225
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
Loading…