Hydrogen Bromide → 5-Cyano-2-[2-(4-methoxyphenyl)ethyl]-3-benzofurancarboxylic acid
Reaction equation
[Br:3].[C:4]([CH3:5])(=[O:6])[c:7]1[c:8]([CH2:18][CH2:19][c:20]2[cH:21][cH:22][c:23]([O:26][CH3:27])[cH:24][cH:25]2)[o:9][c:10]2[c:11]1[cH:12][c:13]([C:16]#[N:17])[cH:14][cH:15]2.[ClH:28].[Na+:2].[O:30]1[CH2:31][CH2:32][O:33][CH2:34][CH2:35]1.[OH-:1].[OH2:29]>>[OH:1][C:4](=[O:6])[c:7]1[c:8]([CH2:18][CH2:19][c:20]2[cH:21][cH:22][c:23]([O:26][CH3:27])[cH:24][cH:25]2)[o:9][c:10]2[c:11]1[cH:12][c:13]([C:16]#[N:17])[cH:14][cH:15]2Participants
8
Sources & evidence
- ORD record
- ord-fb9a9170af5d48e3978b567f11440a8e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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