Benzoic Acid → HCID 178481412, compound
Reaction equation
[CH3:1][N:2]1[C:3](=[O:24])[CH2:4][CH2:5][C:6]2([CH3:23])[c:7]3[c:8]([cH:12][c:13](-[c:16]4[cH:17][c:18]([NH2:22])[cH:19][cH:20][cH:21]4)[cH:14][cH:15]3)[CH2:9][CH2:10][CH:11]12.[CH3:34][N:35]([CH3:36])[CH2:37][CH2:38][CH2:39][N:40]=[C:41]=[N:42][CH2:43][CH3:44].[Cl:45][CH2:46][Cl:47].[OH:25][C:26](=[O:27])[c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1>>[CH3:1][N:2]1[C:3](=[O:24])[CH2:4][CH2:5][C:6]2([CH3:23])[c:7]3[c:8]([cH:12][c:13](-[c:16]4[cH:17][c:18]([NH:22][C:26](=[O:25])[c:28]5[cH:29][cH:30][cH:31][cH:32][cH:33]5)[cH:19][cH:20][cH:21]4)[cH:14][cH:15]3)[CH2:9][CH2:10][CH:11]12Participants
5
Sources & evidence
- ORD record
- ord-4a881467f27c4a4b84eb2b9c0b531a50
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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