Hydrochloric Acid → HCID 10178449, compound
Reaction equation
[CH2:1]1[CH2:2][CH2:3][NH:4][CH2:5][CH2:6]1.[CH3:11][O:12][C:13](=[O:14])[c:15]1[cH:16][c:17]([NH2:30])[c:18]2[n:19]([cH:20]1)[n:21][c:22](-[c:24]1[o:25][c:26]([Br:29])[cH:27][cH:28]1)[n:23]2.[CH3:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1.[CH3:7][Al:8]([CH3:9])[CH3:10].[ClH:31].[O:32]1[CH2:33][CH2:34][O:35][CH2:36][CH2:37]1>>[CH2:1]1[CH2:2][CH2:3][N:4]([C:13](=[O:14])[c:15]2[cH:16][c:17]([NH2:30])[c:18]3[n:19]([cH:20]2)[n:21][c:22](-[c:24]2[o:25][c:26]([Br:29])[cH:27][cH:28]2)[n:23]3)[CH2:5][CH2:6]1Participants
7
Sources & evidence
- ORD record
- ord-55e6ab85b13148c8a70ab26c54265ca2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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