Water → 1-Bromo-4-hydroxy-isoquinoline-3-carboxylic acid butyl ester
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][C:6](=[O:7])[c:8]1[n:9][c:10]([OH:19])[c:11]2[cH:12][cH:13][cH:14][cH:15][c:16]2[c:17]1[OH:18].[CH3:26][C:27]#[N:28].[OH2:25].[P:20]([Br:21])([Br:22])([Br:23])=[O:24]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][C:6](=[O:7])[c:8]1[n:9][c:10]([Br:22])[c:11]2[cH:12][cH:13][cH:14][cH:15][c:16]2[c:17]1[OH:18]Participants
5
Sources & evidence
- ORD record
- ord-4d7be635e5c546fe9f4a4d0fdd307d7c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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