Hydrochloric Acid → [(4-Benzyloxy-1-dimethylcarbamoyl-isoquinoline-3-carbonyl)-amino]-acetic acid benzyl ester
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([C:24](=[O:25])[OH:26])[n:11][c:12]([C:19]([N:20]([CH3:21])[CH3:22])=[O:23])[c:13]2[cH:14][cH:15][cH:16][cH:17][c:18]12.[CH2:28]([c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1)[O:35][C:36]([CH2:37][NH2:38])=[O:39].[Cl:40][CH2:41][Cl:42].[ClH:27]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([C:24](=[O:25])[NH:38][CH2:37][C:36]([O:35][CH2:28][c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)=[O:39])[n:11][c:12]([C:19]([N:20]([CH3:21])[CH3:22])=[O:23])[c:13]2[cH:14][cH:15][cH:16][cH:17][c:18]12Participants
5
Sources & evidence
- ORD record
- ord-893d35194376496ba3bb865afe68234e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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