O-Xylene → HCID 22503346, compound
Reaction equation
[Br:30][c:31]1[n:32][c:33]([N:41]2[CH2:42][CH2:43][N:44]([CH2:47][CH3:48])[CH2:45][CH2:46]2)[c:34]2[cH:35][cH:36][cH:37][cH:38][c:39]2[cH:40]1.[C:1]([CH3:2])(=[O:3])[O:4][CH2:5][c:6]1[cH:7][c:8]([Sn:17]([CH2:18][CH2:19][CH2:20][CH3:21])([CH2:22][CH2:23][CH2:24][CH3:25])[CH2:26][CH2:27][CH2:28][CH3:29])[cH:9][cH:10][c:11]1[CH2:12][O:13][C:14]([CH3:15])=[O:16].[CH3:57][CH2:58][O:59][C:60](=[O:61])[CH3:62].[c:49]1([CH3:50])[c:51]([CH3:52])[cH:53][cH:54][cH:55][cH:56]1>>[C:1]([CH3:2])(=[O:3])[O:4][CH2:5][c:6]1[cH:7][c:8](-[c:31]2[n:32][c:33]([N:41]3[CH2:42][CH2:43][N:44]([CH2:47][CH3:48])[CH2:45][CH2:46]3)[c:34]3[cH:35][cH:36][cH:37][cH:38][c:39]3[cH:40]2)[cH:9][cH:10][c:11]1[CH2:12][O:13][C:14]([CH3:15])=[O:16]Participants
5
Sources & evidence
- ORD record
- ord-a559ebaa045649248dc2f26e6561069e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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