Citric Acid → 1,3-Diethyl 2-[2-(4-bromo-2-chlorophenyl)ethyl]-2-[[(1,1-dimethylethoxy)carbonyl]amino]propanedioate
Reaction equation
[Br:26][c:27]1[cH:28][c:29]([Cl:36])[c:30]([CH2:33][CH2:34][I:35])[cH:31][cH:32]1.[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])[NH:11][C:12](=[O:13])[O:14][C:15]([CH3:16])([CH3:17])[CH3:18])=[O:19].[CH3:20][C:21]([CH3:22])([O-:23])[CH3:24].[CH3:55][N:56]([CH3:57])[CH:58]=[O:59].[Na+:25].[O:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1.[OH:37][C:38]([CH2:39][C:40]([C:41](=[O:42])[OH:43])([CH2:44][C:45](=[O:46])[OH:47])[OH:48])=[O:49]>>[CH2:1]([CH3:2])[O:3][C:4]([C:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])([NH:11][C:12](=[O:13])[O:14][C:15]([CH3:16])([CH3:17])[CH3:18])[CH2:34][CH2:33][c:30]1[c:29]([Cl:36])[cH:28][c:27]([Br:26])[cH:32][cH:31]1)=[O:19]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-da9327883a814651be6ed097a772e7cb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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