2,3-Dichloro-5,6-dicyano-1,4-benzoquinone → acetic acid 2-bromo-6-(6-methylamino-1-oxo-3,4-dihydro-1H-isoquinolin-2-yl)-benzyl ester
Reaction equation
[Br:1][c:2]1[c:3]([CH2:4][O:5][C:6]([CH3:7])=[O:8])[c:9]([N:13]2[C:14](=[O:26])[c:15]3[cH:16][cH:17][c:18]([N:23]([CH3:24])[CH3:25])[cH:19][c:20]3[CH2:21][CH2:22]2)[cH:10][cH:11][cH:12]1.[CH2:41]1[O:42][CH2:43][CH2:44][O:45][CH2:46]1.[Cl:27][C:28]1=[C:39]([Cl:40])[C:37](=[O:38])[C:34]([C:35]#[N:36])=[C:31]([C:32]#[N:33])[C:29]1=[O:30]>>[Br:1][c:2]1[c:3]([CH2:4][O:5][C:6]([CH3:7])=[O:8])[c:9]([N:13]2[C:14](=[O:26])[c:15]3[cH:16][cH:17][c:18]([NH:23][CH3:24])[cH:19][c:20]3[CH2:21][CH2:22]2)[cH:10][cH:11][cH:12]1Participants
4
Sources & evidence
- ORD record
- ord-9800e97c3f484af5878b98ebec9c0c26
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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