5-Bromosalicylic acid → HCID 86595540, compound
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([OH:11])[c:6]([C:7](=[O:8])[OH:9])[cH:10]1.[CH3:12][O:13][C:14]([CH2:15][c:16]1[c:17](-[c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[n:18][c:19]([NH2:21])[s:20]1)=[O:28]>>[Br:1][c:2]1[cH:3][cH:4][c:5]([OH:11])[c:6]([C:7](=[O:9])[NH:21][c:19]2[n:18][c:17](-[c:22]3[cH:23][cH:24][cH:25][cH:26][cH:27]3)[c:16]([CH2:15][C:14]([O:13][CH3:12])=[O:28])[s:20]2)[cH:10]1Participants
3
Sources & evidence
- ORD record
- ord-be43681d452046278b185c0570d90ce0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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