1-(2-(4-(Chloromethyl)phenoxy)ethyl)azepane → 2-[4-(2-Azepan-1-yl-ethoxy)benzyl]-2-(4-methoxy-benzenesulfonyl)pentanoic acid ethyl ester
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([CH2:6][CH2:7][CH3:8])[S:9](=[O:10])(=[O:11])[c:12]1[cH:13][cH:14][c:15]([O:18][CH3:19])[cH:16][cH:17]1)=[O:20].[Cl:21][CH2:22][c:23]1[cH:24][cH:25][c:26]([O:27][CH2:28][CH2:29][N:30]2[CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36]2)[cH:37][cH:38]1>>[CH2:1]([CH3:2])[O:3][C:4]([C:5]([CH2:6][CH2:7][CH3:8])([S:9](=[O:10])(=[O:11])[c:12]1[cH:13][cH:14][c:15]([O:18][CH3:19])[cH:16][cH:17]1)[CH2:22][c:23]1[cH:24][cH:25][c:26]([O:27][CH2:28][CH2:29][N:30]2[CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36]2)[cH:37][cH:38]1)=[O:20]Participants
3
Sources & evidence
- ORD record
- ord-5eec6521fd1f461d91bc28ab14acb26e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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