1,2-Dichloroethane → HCID 57013782, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][N:8]([CH:9]1[CH2:10][c:11]2[cH:12][cH:13][cH:14][cH:15][c:16]2[CH2:17]1)[C:18]([CH:19]([CH:20]([CH3:21])[CH3:22])[NH:23][C:24](=[O:25])[O:26][CH2:27][c:28]1[c:29]2[c:37]([cH:38][cH:39][cH:40]1)-[c:32]1[c:31]([cH:36][cH:35][cH:34][cH:33]1)[CH2:30]2)=[O:41])=[O:42].[CH2:43]([NH:44][CH2:45][CH3:46])[CH3:47].[CH2:57]([Cl:58])[CH2:59][Cl:60].[CH3:61][C:62]#[N:63].[CH3:67][CH2:68][O:69][C:70]([CH3:71])=[O:72].[Cl:64][CH2:65][Cl:66].[O:73]=[CH:74][N:75]([CH3:76])[CH3:77].[OH:48][C:49](=[O:50])[c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][N:8]([CH:9]1[CH2:10][c:11]2[cH:12][cH:13][cH:14][cH:15][c:16]2[CH2:17]1)[C:18]([CH:19]([CH:20]([CH3:21])[CH3:22])[NH:23][C:24](=[O:25])[c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1)=[O:41])=[O:42]Participants
9
Sources & evidence
- ORD record
- ord-de7aa93b62dd4bb187a2b5c9893ca4e5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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