Nitric Acid → 4,6-Dihydroxy-5-nitro-2-trifluoromethyl-nicotinic acid ethyl ester
반응식
[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[c:6]([C:13]([F:14])([F:15])[F:16])[n:7][c:8]([OH:12])[cH:9][c:10]1[OH:11])=[O:17].[OH:18][N+:19]([O-:20])=[O:21].[S:22](=[O:23])(=[O:24])([OH:25])[OH:26]>>[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[c:6]([C:13]([F:14])([F:15])[F:16])[n:7][c:8]([OH:12])[c:9]([N+:19](=[O:18])[O-:20])[c:10]1[OH:11])=[O:17]참가 물질
4
출처 및 근거
- ORD 기록
- ord-03071b188d76401ab5b5cb1c371f86f6
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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