Acetate → 1-Bromo-3,4,5,6-tetrahydro-2,3,10-triaza-benzo[e]azulene
Reaction equation
[CH3:24][C:25](=[O:26])[O-:27].[Cl:28][CH:29]([Cl:30])[CH3:31].[Cl:32][CH2:33][Cl:34].[Na+:23].[O:15]=[C:16]1[N:17]([Br:22])[C:18](=[O:19])[CH2:20][CH2:21]1.[cH:1]1[n:2][nH:3][c:4]2[c:10]1-[c:9]1[c:8]([cH:14][cH:13][cH:12][n:11]1)[CH2:7][CH2:6][CH2:5]2>>[c:1]1([Br:22])[n:2][nH:3][c:4]2[c:10]1-[c:9]1[c:8]([cH:14][cH:13][cH:12][n:11]1)[CH2:7][CH2:6][CH2:5]2Participants
7
Sources & evidence
- ORD record
- ord-9db40fc0fd744ea4a61bfac48e3f82e1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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