Chloride → 2-(3,4-Dimethoxyphenyl)-3-{{[(3,4-dimethoxyphenyl)methyl]carbonyl}amino}propanoic acid ethyl ester
Reaction equation
[CH2:2]([CH3:3])[O:4][C:5]([CH:6]([c:7]1[cH:8][c:9]([O:15][CH3:16])[c:10]([O:13][CH3:14])[cH:11][cH:12]1)[CH2:17][NH2:18])=[O:19].[CH2:62]([Cl:63])[Cl:64].[CH3:23][O:24][c:25]1[cH:26][c:27]([CH2:33][C:34](=[O:35])[OH:36])[cH:28][cH:29][c:30]1[O:31][CH3:32].[CH3:41][O:42][c:43]1[cH:44][c:45]([CH2:46][C:47]([OH:48])=[O:49])[cH:50][cH:51][c:52]1[O:53][CH3:54].[CH3:55][c:56]1[cH:57][cH:58][cH:59][cH:60][cH:61]1.[Cl-:22].[ClH:1].[Na+:21].[OH-:20].[OH2:65].[S:37]([Cl:38])([Cl:39])=[O:40]>>[CH2:2]([CH3:3])[O:4][C:5]([CH:6]([c:7]1[cH:8][c:9]([O:15][CH3:16])[c:10]([O:13][CH3:14])[cH:11][cH:12]1)[CH2:17][NH:18][C:34]([CH2:33][c:27]1[cH:26][c:25]([O:24][CH3:23])[c:30]([O:31][CH3:32])[cH:29][cH:28]1)=[O:35])=[O:19]Participants
11
Reactant 10
Product 1
Sources & evidence
- ORD record
- ord-06a331cbdd5f464899b775647dcc7190
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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