Ethyl isocyanate → 3-Oxo-3H-benzo[d]isoxazole-2-carboxylic acid ethylamide
Reaction equation
[CH2:16]1[O:17][CH2:18][CH2:19][CH2:20]1.[CH2:1]([CH3:2])[N:3]=[C:4]=[O:5].[o:6]1[nH:7][c:8](=[O:15])[c:9]2[c:10]1[cH:11][cH:12][cH:13][cH:14]2>>[CH2:1]([CH3:2])[NH:3][C:4](=[O:5])[n:7]1[o:6][c:10]2[c:9]([c:8]1=[O:15])[cH:14][cH:13][cH:12][cH:11]2Participants
4
Sources & evidence
- ORD record
- ord-d6b2369b2a47461e9bbc0fba8d9594fe
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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