1,4-Dioxane → 5-(4-Bromo-imidazol-1-yl)-2-nitro-4-trifluoromethyl-benzoic acid methyl ester
Reaction equation
[Br:19][c:20]1[n:21][cH:22][nH:23][cH:24]1.[CH2:25]([N:26]([CH:27]([CH3:28])[CH3:29])[CH:30]([CH3:31])[CH3:32])[CH3:33].[CH3:1][O:2][C:3]([c:4]1[c:5]([N+:15](=[O:16])[O-:17])[cH:6][c:7]([C:11]([F:12])([F:13])[F:14])[c:8]([F:10])[cH:9]1)=[O:18].[O:34]1[CH2:35][CH2:36][O:37][CH2:38][CH2:39]1>>[CH3:1][O:2][C:3]([c:4]1[c:5]([N+:15](=[O:16])[O-:17])[cH:6][c:7]([C:11]([F:12])([F:13])[F:14])[c:8](-[n:23]2[cH:22][n:21][c:20]([Br:19])[cH:24]2)[cH:9]1)=[O:18]Participants
5
Sources & evidence
- ORD record
- ord-5704151ad5084f7aa868e2a4886b03fa
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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