Sodium ion → 4-Hydroxy-1-phenoxy-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]([Cl:19])[c:11]2[cH:12][cH:13][cH:14][cH:15][c:16]2[c:17]1[OH:18].[Na+:28].[OH-:27].[OH:20][c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][C:6](=[O:7])[c:8]1[n:9][c:10]([O:20][c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[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-c1b5980ac84842c68a7b19e2089b87ff
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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