Ethyl Acetate → HCID 178492936, compound
Reaction equation
[CH3:48][CH2:49][O:50][C:51]([CH3:52])=[O:53].[F:1][C:2]([c:3]1[cH:4][c:5]([CH:13]2[CH:14]([CH3:45])[N:15]([CH2:19][c:20]3[cH:21][c:22]4[cH:23][cH:24][cH:25][c:26]([N+:42]([O-:43])=[O:44])[c:27]4[cH:28][c:29]3-[c:30]3[c:31]([O:40][CH3:41])[cH:32][c:33]([F:39])[c:34]([CH:36]([CH3:37])[CH3:38])[cH:35]3)[C:16](=[O:18])[O:17]2)[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:46])[F:47]>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH:13]2[CH:14]([CH3:45])[N:15]([CH2:19][c:20]3[cH:21][c:22]4[cH:23][cH:24][cH:25][c:26]([NH2:42])[c:27]4[cH:28][c:29]3-[c:30]3[c:31]([O:40][CH3:41])[cH:32][c:33]([F:39])[c:34]([CH:36]([CH3:37])[CH3:38])[cH:35]3)[C:16](=[O:18])[O:17]2)[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:46])[F:47]Participants
3
Sources & evidence
- ORD record
- ord-2ff5e25444bc489ca9de402937897c58
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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