Sodium ion → 5-[Acetyl-(3,5-bistrifluoromethylbenzyl)amino]-2,3,4,5-tetrahydrobenzo[b]azepine-1-carboxylic acid isopropyl ester
Reaction equation
[CH3:40][C:41](=[O:42])[O:43][C:44](=[O:45])[CH3:46].[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[N:7]1[c:8]2[c:9]([cH:30][cH:31][cH:32][cH:33]2)[CH:10]([NH:14][CH2:15][c:16]2[cH:17][c:18]([C:26]([F:27])([F:28])[F:29])[cH:19][c:20]([C:22]([F:23])([F:24])[F:25])[cH:21]2)[CH2:11][CH2:12][CH2:13]1.[Cl:49][CH2:50][Cl:51].[Na+:48].[OH-:47].[cH:34]1[cH:35][cH:36][n:37][cH:38][cH:39]1>>[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[N:7]1[c:8]2[c:9]([cH:30][cH:31][cH:32][cH:33]2)[CH:10]([N:14]([CH2:15][c:16]2[cH:17][c:18]([C:26]([F:27])([F:28])[F:29])[cH:19][c:20]([C:22]([F:23])([F:24])[F:25])[cH:21]2)[C:41]([CH3:40])=[O:42])[CH2:11][CH2:12][CH2:13]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-f3db21ec25f442a3addfe5060fc6e561
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
Loading…