Acetic Acid → 4-((6-(5-(Cyclopropylcarbamoyl)-2-methylphenyl)-1-oxoisoquinolin-2(1H)-yl)methyl)benzoic acid
Reaction equation
[CH3:38][C:39](=[O:40])[OH:41].[CH3:42][OH:43].[CH:1]1([NH:4][C:5](=[O:6])[c:7]2[cH:8][cH:9][c:10]([CH3:35])[c:11](-[c:13]3[cH:14][c:15]4[cH:16][cH:17][n:18]([CH2:24][c:25]5[cH:26][cH:27][c:28]([C:29](=[O:30])[O:31][CH3:32])[cH:33][cH:34]5)[c:19](=[O:23])[c:20]4[cH:21][cH:22]3)[cH:12]2)[CH2:2][CH2:3]1.[Na+:37].[OH-:36]>>[CH:1]1([NH:4][C:5](=[O:6])[c:7]2[cH:8][cH:9][c:10]([CH3:35])[c:11](-[c:13]3[cH:14][c:15]4[cH:16][cH:17][n:18]([CH2:24][c:25]5[cH:26][cH:27][c:28]([C:29](=[O:30])[OH:31])[cH:33][cH:34]5)[c:19](=[O:23])[c:20]4[cH:21][cH:22]3)[cH:12]2)[CH2:2][CH2:3]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-43b3688af37d48a79f6dc8b240c7b342
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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