Acetic Acid → 2-(3,4-dichlorophenyl)-1-{(4aRS,8SR,8aRS)-4-[(pyridin-3-yl)methyl]-8-(pyrrolidin-1-yl)perhydroquinoxalin-1-yl}ethan-1-one
Reaction equation
[CH3:35][C:36](=[O:37])[OH:38].[CH:27]([c:28]1[cH:29][n:30][cH:31][cH:32][cH:33]1)=[O:34].[Cl:1][c:2]1[cH:3][c:4]([CH2:9][C:10](=[O:11])[N:12]2[CH2:13][CH2:14][NH:15][CH:16]3[CH2:17][CH2:18][CH2:19][CH:20]([N:22]4[CH2:23][CH2:24][CH2:25][CH2:26]4)[CH:21]23)[cH:5][cH:6][c:7]1[Cl:8].[Cl:39][CH2:40][Cl:41]>>[Cl:1][c:2]1[cH:3][c:4]([CH2:9][C:10](=[O:11])[N:12]2[CH2:13][CH2:14][N:15]([CH2:27][c:28]3[cH:29][n:30][cH:31][cH:32][cH:33]3)[CH:16]3[CH2:17][CH2:18][CH2:19][CH:20]([N:22]4[CH2:23][CH2:24][CH2:25][CH2:26]4)[CH:21]23)[cH:5][cH:6][c:7]1[Cl:8]Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-6f8aa176365f4bfdab567fed145f527e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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