Acetic Acid → HCID 21437225, compound
Reaction equation
[CH3:44][C:45](=[O:46])[OH:47].[Cl:39][CH2:40][O:41][CH2:42][CH3:43].[H-:37].[N+:6](=[O:7])([O-:8])[c:9]1[cH:10][c:11]([CH:15]2[C:16]([C:32](=[O:33])[O:34][CH2:35][CH3:36])=[C:17]([CH2:29][CH2:30][CH3:31])[NH:18][C:19]([CH2:26][CH2:27][CH3:28])=[C:20]2[C:21](=[O:22])[O:23][CH2:24][CH3:25])[cH:12][cH:13][cH:14]1.[Na+:38].[O:1]1[CH2:2][CH2:3][CH2:4][CH2:5]1>>[O:1]([CH2:2][CH3:3])[CH2:5][N:18]1[C:17]([CH2:29][CH2:30][CH3:31])=[C:16]([C:32](=[O:33])[O:34][CH2:35][CH3:36])[CH:15]([c:11]2[cH:10][c:9]([N+:6](=[O:7])[O-:8])[cH:14][cH:13][cH:12]2)[C:20]([C:21](=[O:22])[O:23][CH2:24][CH3:25])=[C:19]1[CH2:26][CH2:27][CH3:28]Participants
7
Sources & evidence
- ORD record
- ord-007e5ee2326140f5b3c94f0916ab4dad
- Source dataset
- Validation data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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