Bicarbonate Ion → 7-Hydroxy-8-nitro-1,2,4,5-tetrahydro-benzo[d]azepine-3-carboxylic acid tert-butyl ester
Reaction equation
[C:24](=[O:25])([OH:26])[O-:27].[Cl:29][CH2:30][Cl:31].[Na+:28].[OH:1][N+:2]([O-:3])=[O:4].[OH:5][c:6]1[cH:7][c:8]2[c:9]([cH:22][cH:23]1)[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[CH2:13][CH2:14]2>>[O-:1][N+:2](=[O:4])[c:23]1[c:6]([OH:5])[cH:7][c:8]2[c:9]([cH:22]1)[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[CH2:13][CH2:14]2Participants
6
Sources & evidence
- ORD record
- ord-c910c50b7f61443cb1548fad12bc4cfd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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