Acetic Acid → HCID 178488757, compound
Reaction equation
[CH3:11][CH2:12][OH:13].[CH3:29][C:30](=[O:31])[OH:32].[CH:33]([Cl:34])([Cl:35])[Cl:36].[N+:14](=[O:15])([O-:16])[c:17]1[cH:18][c:19]([O:27][CH3:28])[c:20]([O:25][CH3:26])[cH:21][c:22]1[CH:23]=[O:24].[NH2:1][CH2:2][CH2:3][CH2:4][N:5]1[CH2:6][CH2:7][O:8][CH2:9][CH2:10]1>>[NH2:1][CH2:2][CH2:3][CH2:4][N:5]1[CH2:6][CH2:7][O:8][C:9](=[CH:23][c:22]2[c:17]([N+:14](=[O:15])[O-:16])[cH:18][c:19]([O:27][CH3:28])[c:20]([O:25][CH3:26])[cH:21]2)[CH2:10]1Participants
6
Sources & evidence
- ORD record
- ord-9a62765172114cc8b99920645bd03f1a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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