Methanol → 4-[[Methyl[2-[methyl[[4-[4-(2-oxazolyl)phenoxy]phenyl]methyl]amino]ethyl]amino]methyl]benzoic acid
Reaction equation
[CH3:1][N:2]([CH2:3][CH2:4][N:5]([CH2:6][c:7]1[cH:8][cH:9][c:10]([O:13][c:14]2[cH:15][cH:16][c:17](-[c:20]3[o:21][cH:22][cH:23][n:24]3)[cH:18][cH:19]2)[cH:11][cH:12]1)[CH3:25])[CH2:26][c:27]1[cH:28][cH:29][c:30]([C:31](=[O:32])[O:33][CH3:34])[cH:35][cH:36]1.[CH3:39][OH:40].[Na+:38].[OH-:37]>>[CH3:1][N:2]([CH2:3][CH2:4][N:5]([CH2:6][c:7]1[cH:8][cH:9][c:10]([O:13][c:14]2[cH:15][cH:16][c:17](-[c:20]3[o:21][cH:22][cH:23][n:24]3)[cH:18][cH:19]2)[cH:11][cH:12]1)[CH3:25])[CH2:26][c:27]1[cH:28][cH:29][c:30]([C:31](=[O:32])[OH:33])[cH:35][cH:36]1Participants
5
Sources & evidence
- ORD record
- ord-dcd4a160e76944dca5b7b371379ecfb8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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