1,2-Dichloroethane → HCID 23512434, compound
Reaction equation
[CH2:55]([Cl:56])[CH2:57][Cl:58].[CH3:22][O:23][c:24]1[cH:25][c:26]([CH2:41][C:42](=[O:43])[OH:44])[cH:27][cH:28][c:29]1[NH:30][C:31](=[O:32])[NH:33][c:34]1[c:35]([CH3:40])[cH:36][cH:37][cH:38][cH:39]1.[CH3:59][N:60]([c:61]1[cH:62][cH:63][n:64][cH:65][cH:66]1)[CH3:67].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([C:7](=[O:8])[O:9][CH3:10])[cH:11][cH:12][c:13]1[O:14][CH2:15][C:16]1([CH3:21])[NH:17][CH2:18][CH2:19][CH2:20]1.[O:68]=[CH:69][N:70]([CH3:71])[CH3:72].[OH:45][n:46]1[c:47]2[c:48]([cH:49][cH:50][cH:51][cH:52]2)[n:53][n:54]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([C:7](=[O:8])[O:9][CH3:10])[cH:11][cH:12][c:13]1[O:14][CH2:15][C:16]1([CH3:21])[N:17]([C:42]([CH2:41][c:26]2[cH:25][c:24]([O:23][CH3:22])[c:29]([NH:30][C:31](=[O:32])[NH:33][c:34]3[c:35]([CH3:40])[cH:36][cH:37][cH:38][cH:39]3)[cH:28][cH:27]2)=[O:43])[CH2:18][CH2:19][CH2:20]1Participants
7
Sources & evidence
- ORD record
- ord-2e2626b8fb34485185f5a81c998417ea
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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