Hydrochloric Acid → HCID 54438915, compound
Reaction equation
[C:1](=[O:2])([OH:3])[c:4]1[cH:5][cH:6][c:7]([CH:10]=[CH:11][C:12](=[O:13])[NH:14][CH2:15][C:16](=[O:17])[N:18]([CH3:19])[c:20]2[c:21]([Cl:40])[c:22]([CH2:23][O:24][c:25]3[cH:26][cH:27][cH:28][c:29]4[cH:30][cH:31][c:32]([CH3:35])[n:33][c:34]34)[c:36]([Cl:39])[cH:37][cH:38]2)[cH:8][n:9]1.[CH2:49]([N:50]=[C:51]=[N:52][CH2:53][CH2:54][CH2:55][N:56]([CH3:57])[CH3:58])[CH3:59].[CH3:71][N:72]([CH3:73])[CH:74]=[O:75].[ClH:48].[NH2:41][c:42]1[n:43][cH:44][cH:45][n:46][cH:47]1.[OH2:70].[OH:60][n:61]1[c:62]2[cH:63][cH:64][cH:65][cH:66][c:67]2[n:68][n:69]1>>[C:1](=[O:3])([c:4]1[cH:5][cH:6][c:7]([CH:10]=[CH:11][C:12](=[O:13])[NH:14][CH2:15][C:16](=[O:17])[N:18]([CH3:19])[c:20]2[c:21]([Cl:40])[c:22]([CH2:23][O:24][c:25]3[cH:26][cH:27][cH:28][c:29]4[cH:30][cH:31][c:32]([CH3:35])[n:33][c:34]34)[c:36]([Cl:39])[cH:37][cH:38]2)[cH:8][n:9]1)[NH:41][c:42]1[n:43][cH:44][cH:45][n:46][cH:47]1Participants
8
Sources & evidence
- ORD record
- ord-cd8227bd32ce4f268881c2e4f73ee3cf
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
Loading…