Bicarbonate Ion → 1-[4-(7-Chloro-1-methoxy-isoquinolin-6-yloxy)-1-trifluoromethyl-cyclohexyl]-propylamine
Reaction equation
[Cl:18][c:19]1[c:20]([F:31])[cH:21][c:22]2[cH:23][cH:24][n:25][c:26]([O:29][CH3:30])[c:27]2[cH:28]1.[H-:2].[NH2:3][CH:4]([CH2:5][CH3:6])[C:7]1([C:14]([F:15])([F:16])[F:17])[CH2:8][CH2:9][CH:10]([OH:13])[CH2:11][CH2:12]1.[Na+:1].[Na+:36].[O-:32][C:33]([OH:34])=[O:35]>>[NH2:3][CH:4]([CH2:5][CH3:6])[C:7]1([C:14]([F:15])([F:16])[F:17])[CH2:8][CH2:9][CH:10]([O:13][c:20]2[c:19]([Cl:18])[cH:28][c:27]3[c:22]([cH:21]2)[cH:23][cH:24][n:25][c:26]3[O:29][CH3:30])[CH2:11][CH2:12]1Participants
6
Sources & evidence
- ORD record
- ord-5500e5e56bd94cf2aee439c96448ac0b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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