Acetic Acid → HCID 88662905, compound
Reaction equation
[CH3:47][C:48](=[O:49])[OH:50].[Cl:51][CH2:52][Cl:53].[OH:1][N:2]=[C:3]([C:4](=[O:5])[OH:6])[c:7]1[n:8][c:9]([NH:12][C:13]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)([c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[s:10][cH:11]1.[c:32]1([C:38](=[N+:39]=[N-:40])[c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[cH:33][cH:34][cH:35][cH:36][cH:37]1>>[OH:1][N:2]=[C:3]([C:4](=[O:5])[O:6][CH:38]([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)[c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1)[c:7]1[n:8][c:9]([NH:12][C:13]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)([c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[s:10][cH:11]1Participants
5
Sources & evidence
- ORD record
- ord-8488b27c5d2f4673b92f8aa7644acc40
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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