Hydrochloric Acid → Benzyl {1-(4-bromobenzyl)-2-[(2-hydroxy-4,4-dimethylhexyl)amino]-2-oxoethyl}carbamate
Reaction equation
[C:1](=[O:2])([OH:3])[O-:4].[CH2:61]([Cl:62])[Cl:63].[CH2:6]([c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1)[O:13][C:14](=[O:15])[NH:16][CH:17]([C:18](=[O:19])[OH:20])[CH2:21][c:22]1[cH:23][cH:24][c:25]([Br:28])[cH:26][cH:27]1.[CH3:40][N:41]([CH3:42])[CH2:43][CH2:44][CH2:45][N:46]=[C:47]=[N:48][CH2:49][CH3:50].[ClH:39].[NH2:29][CH2:30][CH:31]([CH2:32][C:33]([CH2:34][CH3:35])([CH3:36])[CH3:37])[OH:38].[Na+:5].[OH:51][n:52]1[c:53]2[cH:54][cH:55][cH:56][cH:57][c:58]2[n:59][n:60]1>>[CH2:6]([c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1)[O:13][C:14](=[O:15])[NH:16][CH:17]([C:18](=[O:20])[NH:29][CH2:30][CH:31]([CH2:32][C:33]([CH2:34][CH3:35])([CH3:36])[CH3:37])[OH:38])[CH2:21][c:22]1[cH:23][cH:24][c:25]([Br:28])[cH:26][cH:27]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-439a811828cc45429428928ff700d1e3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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