Acetic Acid → HCID 70221220, compound
Reaction equation
[C:13]([n:14]1[cH:15][cH:16][n:17][cH:18]1)([n:19]1[cH:20][cH:21][n:22][cH:23]1)=[O:24].[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][cH:7][c:8]([C:10](=[O:11])[OH:12])[s:9]1.[CH3:39][C:40](=[O:41])[OH:42].[CH3:43][N:44]([c:45]1[cH:46][cH:47][n:48][cH:49][cH:50]1)[CH3:51].[CH3:52][N:53]([CH3:54])[CH:55]=[O:56].[Cl:25][c:26]1[cH:27][c:28]2[c:32]([cH:33][cH:34]1)[N:31]([C:35](=[O:36])[NH2:37])[C:30](=[O:38])[CH2:29]2>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][cH:7][c:8]([C:10](=[O:12])[CH:29]2[c:28]3[cH:27][c:26]([Cl:25])[cH:34][cH:33][c:32]3[N:31]([C:35](=[O:36])[NH2:37])[C:30]2=[O:38])[s:9]1Participants
7
Sources & evidence
- ORD record
- ord-b212f4aadbfb491eb4d0a132814a3cac
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
Loading…