Hydrochloric Acid → Methyl 2-[(1-chloro-4-hydroxy-7-phenylmethoxyisoquinoline-3-carbonyl)amino]propanoate
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]2[c:13]([OH:23])[c:14]([C:20](=[O:21])[OH:22])[n:15][c:16]([Cl:19])[c:17]2[cH:18]1.[CH3:25][O:26][C:27]([CH:28]([NH2:29])[CH3:30])=[O:31].[ClH:24]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]2[c:13]([OH:23])[c:14]([C:20](=[O:21])[NH:29][CH:28]([C:27]([O:26][CH3:25])=[O:31])[CH3:30])[n:15][c:16]([Cl:19])[c:17]2[cH:18]1Participants
4
Sources & evidence
- ORD record
- ord-df7e768e7dd643748ba8c79d22e1b2bc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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