1,2-Dichloroethane → HCID 16124990, compound
Reaction equation
[C:1]12([c:11]3[cH:12][cH:13][c:14]([O:15][CH2:16][C:17](=[O:18])[NH:19][c:20]4[cH:21][c:22]([C:23](=[O:24])[OH:25])[cH:26][cH:27][cH:28]4)[cH:29][cH:30]3)[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2.[CH2:49]([Cl:50])[CH2:51][Cl:52].[CH3:68][CH2:69][O:70][C:71](=[O:72])[CH3:73].[CH:40]([N:41]([CH2:42][CH3:43])[CH:44]([CH3:45])[CH3:46])([CH3:47])[CH3:48].[NH2:31][CH2:32][CH2:33][c:34]1[cH:35][cH:36][n:37][cH:38][cH:39]1.[O:63]=[CH:64][N:65]([CH3:66])[CH3:67].[OH:53][n:54]1[c:55]2[c:56]([cH:57][cH:58][cH:59][cH:60]2)[n:61][n:62]1>>[C:1]12([c:11]3[cH:12][cH:13][c:14]([O:15][CH2:16][C:17](=[O:18])[NH:19][c:20]4[cH:21][c:22]([C:23](=[O:25])[NH:31][CH2:32][CH2:33][c:34]5[cH:35][cH:36][n:37][cH:38][cH:39]5)[cH:26][cH:27][cH:28]4)[cH:29][cH:30]3)[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2Participants
8
Sources & evidence
- ORD record
- ord-0ca46495727841f7a4b815f86d52388e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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