1,2-Dichloroethane → HCID 178249126, compound
Reaction equation
[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[N:8]1[CH:9]([C:16](=[O:17])[OH:18])[CH2:10][CH:11]([N:13]=[N+:14]=[N-:15])[CH2:12]1.[CH2:45]([Cl:46])[CH2:47][Cl:48].[CH3:28][N:29]1[CH2:30][CH2:31][NH:32][CH2:33][CH2:34]1.[CH:19]([N:20]([CH2:21][CH3:22])[CH:23]([CH3:24])[CH3:25])([CH3:26])[CH3:27].[O:49]=[CH:50][N:51]([CH3:52])[CH3:53].[OH:35][n:36]1[c:37]2[c:38]([cH:39][cH:40][cH:41][cH:42]2)[n:43][n:44]1>>[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[N:8]1[CH:9]([C:16](=[O:18])[N:32]2[CH2:31][CH2:30][N:29]([CH3:28])[CH2:34][CH2:33]2)[CH2:10][CH:11]([N:13]=[N+:14]=[N-:15])[CH2:12]1Participants
7
Sources & evidence
- ORD record
- ord-57b194e274ca44cca7d50a819642e6ad
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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