Sodium ion → 2-[2-Methyl-3-(trifluoromethyl)anilino]-5-nitrobenzoic acid
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[CH2:14]([OH:15])[CH2:16][CH2:17][CH2:18][CH3:19].[CH3:22][c:23]1[c:24]([NH2:25])[cH:26][cH:27][cH:28][c:29]1[C:30]([F:31])([F:32])[F:33].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][c:8]([N+:11](=[O:12])[O-:13])[cH:9][cH:10]1.[Cu:34].[Na+:21].[OH-:20]>>[c:2]1([NH:25][c:24]2[c:23]([CH3:22])[c:29]([C:30]([F:31])([F:32])[F:33])[cH:28][cH:27][cH:26]2)[c:3]([C:4](=[O:5])[OH:6])[cH:7][c:8]([N+:11](=[O:12])[O-:13])[cH:9][cH:10]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-c5fffac6704849318b37a2b3453f7bfd
- 출처 데이터셋
- Test data from https://doi.org/10.1039/C8SC04228D
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