Sodium ion → 1-[2-(N-isopropyl-N-heptylamino)propyl]-9-hydroxy-3,4,5,5a,6,7-hexahydro-2H-naphth[1,2-d]azepin-2-one
Reaction equation
[B:33]([Br:34])([Br:35])[Br:36].[CH2:43]([Cl:44])[Cl:45].[CH:1]([CH3:2])([CH3:3])[N:4]([CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH3:11])[CH:12]([CH2:13][C:14]1=[C:20]2[CH:19]([CH2:18][CH2:17][NH:16][C:15]1=[O:31])[CH2:28][CH2:27][c:26]1[c:21]2[cH:22][cH:23][c:24]([O:29][CH3:30])[cH:25]1)[CH3:32].[Na+:37].[Na+:38].[O-:39][C:40](=[O:41])[O-:42]>>[CH:1]([CH3:2])([CH3:3])[N:4]([CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH3:11])[CH:12]([CH2:13][C:14]1=[C:20]2[CH:19]([CH2:18][CH2:17][NH:16][C:15]1=[O:31])[CH2:28][CH2:27][c:26]1[c:21]2[cH:22][cH:23][c:24]([OH:29])[cH:25]1)[CH3:32]Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-14b3fa251b5f4b328d2d620e43119924
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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