Hydrochloric Acid → [(4-Aminomethyl-benzyl)-(4-dipropylamino-butyl)-amino]-acetic acid ethyl ester
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][N:6]([CH2:7][CH2:8][CH2:9][CH2:10][N:11]([CH2:12][CH2:13][CH3:14])[CH2:15][CH2:16][CH3:17])[CH2:18][c:19]1[cH:20][cH:21][c:22]([CH2:25][NH:26][C:27]([O:28][C:29]([CH3:30])([CH3:31])[CH3:32])=[O:33])[cH:23][cH:24]1)=[O:34].[CH3:42][CH2:43][OH:44].[ClH:41].[O:35]1[CH2:36][CH2:37][O:38][CH2:39][CH2:40]1>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][N:6]([CH2:7][CH2:8][CH2:9][CH2:10][N:11]([CH2:12][CH2:13][CH3:14])[CH2:15][CH2:16][CH3:17])[CH2:18][c:19]1[cH:20][cH:21][c:22]([CH2:25][NH2:26])[cH:23][cH:24]1)=[O:34]Participants
5
Sources & evidence
- ORD record
- ord-b6a5d683375b4ebab74e5dd1913f3a1f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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