O-Xylene → HCID 22503385, compound
Reaction equation
[Br:34][c:35]1[n:36][c:37]([N:45]2[CH2:46][CH2:47][N:48]([CH2:51][CH3:52])[CH2:49][CH2:50]2)[c:38]2[cH:39][cH:40][cH:41][cH:42][c:43]2[cH:44]1.[CH3:1][N:2]([C:3]([c:4]1[cH:5][cH:6][c:7]([Sn:10]([CH2:11][CH2:12][CH2:13][CH3:14])([CH2:15][CH2:16][CH2:17][CH3:18])[CH2:19][CH2:20][CH2:21][CH3:22])[cH:8][cH:9]1)=[O:23])[CH2:24][CH2:25][O:26][CH2:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[CH3:61][CH2:62][O:63][C:64](=[O:65])[CH3:66].[c:53]1([CH3:54])[c:55]([CH3:56])[cH:57][cH:58][cH:59][cH:60]1>>[CH3:1][N:2]([C:3]([c:4]1[cH:5][cH:6][c:7](-[c:35]2[n:36][c:37]([N:45]3[CH2:46][CH2:47][N:48]([CH2:51][CH3:52])[CH2:49][CH2:50]3)[c:38]3[cH:39][cH:40][cH:41][cH:42][c:43]3[cH:44]2)[cH:8][cH:9]1)=[O:23])[CH2:24][CH2:25][O:26][CH2:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1Participants
5
Sources & evidence
- ORD record
- ord-9d038ea0a7be49abbda64362c89214a0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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