Water → 1-(2-isopropylaminoethyl)-3,4,5,5a,6,7-hexahydro-9-methoxy-2H-naphth[1,2-d]azepin-2-one
Reaction equation
[CH2:9]([Li:10])[CH2:11][CH2:12][CH3:13].[CH3:1][N:2]([CH3:3])[CH2:4][CH2:5][N:6]([CH3:7])[CH3:8].[CH3:40][CH2:41][CH2:42][CH2:43][CH2:44][CH3:45].[CH:14]([CH3:15])([CH3:16])[NH:17][CH:18]([CH2:19][C:20]1=[C:26]2[CH:25]([CH2:24][CH2:23][NH:22][C:21]1=[O:37])[CH2:34][CH2:33][c:32]1[c:27]2[cH:28][cH:29][c:30]([O:35][CH3:36])[cH:31]1)[CH3:38].[O:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1.[OH2:39]>>[CH:14]([CH3:15])([CH3:16])[NH:17][CH2:18][CH2:19][C:20]1=[C:26]2[CH:25]([CH2:24][CH2:23][NH:22][C:21]1=[O:37])[CH2:34][CH2:33][c:32]1[c:27]2[cH:28][cH:29][c:30]([O:35][CH3:36])[cH:31]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-f0a369403b9f442e9d515c2bde4e556a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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