Hexane → 4,6-Dibromo-2-[2-(4-methoxy-3-nitro-phenyl)-propionylamino]-benzoic acid methyl ester
Reaction equation
[CH3:1][O:2][c:3]1[c:4]([N+:14](=[O:15])[O-:16])[cH:5][c:6]([CH:9]([C:10](=[O:11])[OH:12])[CH3:13])[cH:7][cH:8]1.[CH3:21][O:22][C:23]([c:24]1[c:25]([NH2:32])[cH:26][c:27]([Br:31])[cH:28][c:29]1[Br:30])=[O:33].[CH3:34][CH2:35][CH2:36][CH2:37][CH2:38][CH3:39].[CH3:40][CH2:41][O:42][C:43]([CH3:44])=[O:45].[S:17]([Cl:18])([Cl:19])=[O:20]>>[CH3:1][O:2][c:3]1[c:4]([N+:14](=[O:15])[O-:16])[cH:5][c:6]([CH:9]([C:10](=[O:12])[NH:32][c:25]2[c:24]([C:23]([O:22][CH3:21])=[O:33])[c:29]([Br:30])[cH:28][c:27]([Br:31])[cH:26]2)[CH3:13])[cH:7][cH:8]1Participants
6
Sources & evidence
- ORD record
- ord-249e613ff35d4938b3218709c194aff9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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