Acetic Acid → N-[1-(3,5-Diethoxy-4-pyrrol-1-yl-benzyl)-piperidin-4-yl]-2,6-dimethyl-terephthalamic acid
Reaction equation
[C:40]([BH3-:41])#[N:42].[CH2:21]([CH3:22])[O:23][c:24]1[cH:25][c:26]([CH:27]=[O:28])[cH:29][c:30]([O:37][CH2:38][CH3:39])[c:31]1-[n:32]1[cH:33][cH:34][cH:35][cH:36]1.[CH2:44]([N:45]([CH:46]([CH3:47])[CH3:48])[CH:49]([CH3:50])[CH3:51])[CH3:52].[CH3:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[c:7]([CH3:20])[cH:8][c:9]([C:11](=[O:12])[NH:13][CH:14]2[CH2:15][CH2:16][NH:17][CH2:18][CH2:19]2)[cH:10]1.[CH3:53][CH2:54][OH:55].[CH3:56][C:57](=[O:58])[OH:59].[Na+:43]>>[CH3:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[c:7]([CH3:20])[cH:8][c:9]([C:11](=[O:12])[NH:13][CH:14]2[CH2:15][CH2:16][N:17]([CH2:27][c:26]3[cH:25][c:24]([O:23][CH2:21][CH3:22])[c:31](-[n:32]4[cH:33][cH:34][cH:35][cH:36]4)[c:30]([O:37][CH2:38][CH3:39])[cH:29]3)[CH2:18][CH2:19]2)[cH:10]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-8bc3a6b1311b4a2dbe1d3903781d992a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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