Hydrochloric Acid → 2-methyl-N-(5-methyl-6-oxo-6,7-dihydro-5H-dibenzo[b,d]azepin-7-yl)-malonamic acid tert-butyl ester
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH:7]([C:8](=[O:9])[OH:10])[CH3:11])=[O:12].[CH2:62]1[O:63][CH2:64][CH2:65][CH2:66]1.[CH3:51][N:52]([CH3:53])[CH2:54][CH2:55][CH2:56][N:57]=[C:58]=[N:59][CH2:60][CH3:61].[CH:41]([N:42]([CH:43]([CH3:44])[CH3:45])[CH2:46][CH3:47])([CH3:48])[CH3:49].[ClH:50].[NH2:13][CH:14]1[c:15]2[c:16]([cH:27][cH:28][cH:29][cH:30]2)-[c:17]2[c:18]([cH:23][cH:24][cH:25][cH:26]2)[N:19]([CH3:22])[C:20]1=[O:21].[OH:31][c:32]1[c:33]2[n:34][n:35][nH:36][c:37]2[cH:38][cH:39][cH:40]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH:7]([C:8](=[O:10])[NH:13][CH:14]1[c:15]2[c:16]([cH:27][cH:28][cH:29][cH:30]2)-[c:17]2[c:18]([cH:23][cH:24][cH:25][cH:26]2)[N:19]([CH3:22])[C:20]1=[O:21])[CH3:11])=[O:12]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-b8844d4debea4de99e5b01c28ff9ee6a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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