3-Methyl-5-nitroisoquinoline → HCID 69522806, compound
Reaction equation
[CH3:15][c:16]1[n:17][cH:18][c:19]2[c:20]([N+:26]([O-:27])=[O:28])[cH:21][cH:22][cH:23][c:24]2[cH:25]1.[CH3:1][c:2]1[n:3][cH:4][c:5]2[c:6]([cH:7]1)[c:8]([N+:9]([O-:10])=[O:11])[cH:12][cH:13][cH:14]2.[F:29][C:30]([c:31]1[cH:32][cH:33][c:34]([CH2:35][N:36]=[C:37]=[O:38])[cH:39][cH:40]1)([F:41])[F:42]>>[CH3:15][c:16]1[n:17][cH:18][c:19]2[c:20]([NH:26][C:37]([NH:36][CH2:35][c:34]3[cH:33][cH:32][c:31]([C:30]([F:29])([F:41])[F:42])[cH:40][cH:39]3)=[O:38])[cH:21][cH:22][cH:23][c:24]2[cH:25]1Participants
4
Sources & evidence
- ORD record
- ord-ccade2b92ed94ad6b48a629c6a7c2f16
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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