Ammonium → 7-(2-hydroxyethylamino)-3-(2-trifluoromethylphenyl)-2H-isoquinolin-1-one
Reaction equation
[C:24]([Si:25]([CH3:26])([CH3:27])[O:29][CH2:30][CH2:31][NH:32][c:33]1[cH:34][cH:35][c:36]2[cH:37][c:38](-[c:44]3[c:45]([C:50]([F:51])([F:52])[F:53])[cH:46][cH:47][cH:48][cH:49]3)[nH:39][c:40](=[O:43])[c:41]2[cH:42]1)([CH3:28])([CH3:54])[CH3:55].[CH2:19]1[O:20][CH2:21][CH2:22][CH2:23]1.[CH2:2]([N+:3]([CH2:4][CH2:5][CH2:6][CH3:7])([CH2:8][CH2:9][CH2:10][CH3:11])[CH2:12][CH2:13][CH2:14][CH3:15])[CH2:16][CH2:17][CH3:18].[CH3:58][CH2:59][O:60][C:61](=[O:62])[CH3:63].[Cl-:56].[F-:1].[NH4+:57]>>[OH:29][CH2:30][CH2:31][NH:32][c:33]1[cH:34][cH:35][c:36]2[cH:37][c:38](-[c:44]3[c:45]([C:50]([F:51])([F:52])[F:53])[cH:46][cH:47][cH:48][cH:49]3)[nH:39][c:40](=[O:43])[c:41]2[cH:42]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-996bba43d5d541719eaec7b87a14bb39
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
Loading…