Acetic Acid → 4-Hydroxy-7-{1-(tert-butoxycarbonyl)-5-[4-(2-hydroxyethyl)piperazin-1-ylmethyl]indol-2-yl}isoindolinone
Reaction equation
[C:43]([O:44][BH-:45]([O:46][C:47](=[O:48])[CH3:49])[O:50][C:51](=[O:52])[CH3:53])(=[O:54])[CH3:55].[CH3:39][C:40](=[O:41])[OH:42].[CH3:58][C:59]#[N:60].[ClH:57].[Na+:56].[OH:1][c:2]1[c:3]2[c:7]([c:8](-[c:11]3[n:12]([C:22](=[O:23])[O:24][C:25]([CH3:26])([CH3:27])[CH3:28])[c:13]4[cH:14][cH:15][c:16]([CH:20]=[O:21])[cH:17][c:18]4[cH:19]3)[cH:9][cH:10]1)[C:6](=[O:29])[NH:5][CH2:4]2.[OH:30][CH2:31][CH2:32][N:33]1[CH2:34][CH2:35][NH:36][CH2:37][CH2:38]1>>[OH:1][c:2]1[c:3]2[c:7]([c:8](-[c:11]3[n:12]([C:22](=[O:23])[O:24][C:25]([CH3:26])([CH3:27])[CH3:28])[c:13]4[cH:14][cH:15][c:16]([CH2:20][N:36]5[CH2:35][CH2:34][N:33]([CH2:32][CH2:31][OH:30])[CH2:38][CH2:37]5)[cH:17][c:18]4[cH:19]3)[cH:9][cH:10]1)[C:6](=[O:29])[NH:5][CH2:4]2Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-b5f8eed6e30f4c4eae326f659f700ee8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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