Sodium ion → Benzeneacetic acid, 3,4-dihydroxy-5-nitro-alpha-oxo-, ethyl ester
Reaction equation
[CH3:20][C:21]#[N:22].[CH3:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1.[I-:24].[Na+:23].[OH:1][c:2]1[c:3]([O:18][CH3:19])[cH:4][c:5]([C:11]([C:12](=[O:13])[O:14][CH2:15][CH3:16])=[O:17])[cH:6][c:7]1[N+:8](=[O:9])[O-:10].[Si:25]([Cl:26])([Cl:27])([Cl:28])[Cl:29]>>[OH:1][c:2]1[c:3]([OH:18])[cH:4][c:5]([C:11]([C:12](=[O:13])[O:14][CH2:15][CH3:16])=[O:17])[cH:6][c:7]1[N+:8](=[O:9])[O-:10]Participants
7
Sources & evidence
- ORD record
- ord-a71ca4ed30474bdc9975a98a3b878872
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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