1,2-Dichloroethane → HCID 18341488, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([CH2:10][CH:11]([C:12](=[O:13])[NH:14][CH:15]([C:16]([CH3:17])([CH3:18])[CH3:19])[C:20]([NH:21][CH3:22])=[O:23])[n:24]1[cH:25][c:26](-[c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[cH:27][cH:28]1)=[O:35].[CH2:36]([O:37][C:38](=[O:39])[CH2:40][CH:41]([NH:42][C:43]([O:44][C:45]([CH3:46])([CH3:47])[CH3:48])=[O:49])[C:50]([NH:51][CH:52]([C:53](=[O:54])[NH:55][CH3:56])[C:57]([CH3:58])([CH3:59])[CH3:60])=[O:61])[c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1.[CH2:68]([CH:69]([NH:70][C:71](=[O:72])[CH:73]([n:74]1[cH:75][cH:76][c:77](-[c:78]2[cH:79][cH:80][c:81](-[c:96]3[cH:97][cH:98][c:99]([C:102]([NH2:103])=[O:104])[cH:100][cH:101]3)[cH:82][cH:83]2)[cH:84]1)[CH2:85][C:86]([OH:87])=[O:88])[CH2:89][OH:90])[c:91]1[cH:92][cH:93][cH:94][cH:95][cH:105]1.[Cl:106][CH2:107][CH2:108][Cl:109]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([CH2:10][CH:11]([C:12](=[O:13])[NH:14][CH:15]([C:16]([CH3:17])([CH3:18])[CH3:19])[C:20]([NH:21][CH3:22])=[O:23])[n:24]1[cH:25][c:26](-[c:29]2[cH:30][cH:31][c:32](-[c:96]3[cH:97][cH:98][c:99]([C:102]([NH2:103])=[O:104])[cH:100][cH:101]3)[cH:33][cH:34]2)[cH:27][cH:28]1)=[O:35]Participants
5
Sources & evidence
- ORD record
- ord-37ccb91f3fe346709a256887571282f9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
Loading…