Acetic Acid → [5-(1H-indol-2-yl)-2-methoxy-phenyl]-(3-nitro-benzyl)-amine
Reaction equation
[C:30]([O:31][BH-:32]([O:33][C:34](=[O:35])[CH3:36])[O:37][C:38](=[O:39])[CH3:40])(=[O:41])[CH3:42].[C:44](=[O:45])([OH:46])[O-:47].[CH2:49]([Cl:50])[Cl:51].[CH3:52][C:53](=[O:54])[OH:55].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([CH:7]=[O:8])[cH:9][cH:10][cH:11]1.[Na+:43].[Na+:48].[nH:12]1[c:13](-[c:21]2[cH:22][cH:23][c:24]([O:28][CH3:29])[c:25]([NH2:27])[cH:26]2)[cH:14][c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]12>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([CH2:7][NH:27][c:25]2[c:24]([O:28][CH3:29])[cH:23][cH:22][c:21](-[c:13]3[nH:12][c:20]4[c:15]([cH:14]3)[cH:16][cH:17][cH:18][cH:19]4)[cH:26]2)[cH:9][cH:10][cH:11]1Participants
8
Sources & evidence
- ORD record
- ord-f7936ceaeca24469b91536fb0d486e0d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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