Benzene → HCID 178481438, compound
Reaction equation
[CH2:40]1[O:41][CH2:42][CH2:43][CH2:44]1.[CH3:1][N:2]1[C:3](=[O:20])[CH2:4][CH2:5][C:6]2([CH3:19])[c:7]3[c:8]([cH:12][c:13]([C:16](=[O:17])[OH:18])[cH:14][cH:15]3)[CH2:9][CH2:10][CH:11]12.[CH3:45][CH2:46][O:47][C:48](=[O:49])[CH3:50].[CH3:51][N:52]([CH3:53])[CH:54]=[O:55].[Cl:21][C:22]([C:23]([Cl:24])=[O:25])=[O:26].[OH:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[cH:34]1[cH:35][cH:36][n:37][cH:38][cH:39]1.[cH:56]1[cH:57][cH:58][cH:59][cH:60][cH:61]1>>[CH3:1][N:2]1[C:3](=[O:20])[CH2:4][CH2:5][C:6]2([CH3:19])[c:7]3[c:8]([cH:12][c:13]([C:16](=[O:17])[O:18][c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[cH:14][cH:15]3)[CH2:9][CH2:10][CH:11]12Participants
9
Sources & evidence
- ORD record
- ord-ccef25f59ecc41c481d7b71aed919101
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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