2-Bromopropane → HCID 10211692, compound
Reaction equation
[Br:46][CH:47]([CH3:48])[CH3:49].[O:1]1[CH2:2][O:3][c:4]2[c:5]1[cH:6][cH:7][c:8]([CH2:10][NH:11][C:12]([CH:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[N:20]1[CH:21]([CH2:34][c:35]3[cH:36][c:37]([O:43][CH3:44])[c:38]([O:41][CH3:42])[cH:39][cH:40]3)[c:22]3[c:23]([cH:27][c:28]([O:32][CH3:33])[c:29]([OH:31])[cH:30]3)[CH2:24][CH2:25][CH2:26]1)=[O:45])[cH:9]2>>[O:1]1[CH2:2][O:3][c:4]2[c:5]1[cH:6][cH:7][c:8]([CH2:10][NH:11][C:12]([CH:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[N:20]1[CH:21]([CH2:34][c:35]3[cH:36][c:37]([O:43][CH3:44])[c:38]([O:41][CH3:42])[cH:39][cH:40]3)[c:22]3[c:23]([cH:27][c:28]([O:32][CH3:33])[c:29]([O:31][CH:47]([CH3:48])[CH3:49])[cH:30]3)[CH2:24][CH2:25][CH2:26]1)=[O:45])[cH:9]2Participants
3
Sources & evidence
- ORD record
- ord-827d09485dfd4df8b6a41e82a046ea0a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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