Sodium ion → [4-(4-dipropylaminomethylphenylcarbamoyl)benzyl]carbamic Acid t-butyl Ester
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][c:10]1[cH:11][cH:12][c:13]([C:14](=[O:15])[OH:16])[cH:17][cH:18]1.[CH2:29]([CH2:30][CH3:31])[N:32]([CH2:33][CH2:34][CH3:35])[CH2:36][c:37]1[cH:38][cH:39][c:40]([NH2:41])[cH:42][cH:43]1.[CH:46]([Cl:47])([Cl:48])[Cl:49].[Na+:45].[OH-:44].[OH:19][n:20]1[c:21]2[c:22]([cH:23][cH:24][cH:25][cH:26]2)[n:27][n:28]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][c:10]1[cH:11][cH:12][c:13]([C:14](=[O:16])[NH:41][c:40]2[cH:39][cH:38][c:37]([CH2:36][N:32]([CH2:29][CH2:30][CH3:31])[CH2:33][CH2:34][CH3:35])[cH:43][cH:42]2)[cH:17][cH:18]1Participants
7
Sources & evidence
- ORD record
- ord-6b7645b0c87945baaf87a87c802896b7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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