1-Butanol → 5-Nitro-2-(2-[4-phenyl-1-piperazinyl]ethylamino)benzoic acid
반응식
[CH2:35]([OH:36])[CH2:37][CH:38]([CH3:39])[CH3:40].[CH2:41]([OH:42])[CH2:43][CH2:44][CH3:45].[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.[K+:29].[K+:30].[NH2:14][CH2:15][CH2:16][N:17]1[CH2:18][CH2:19][N:20]([c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[CH2:21][CH2:22]1.[O-:31][C:32]([O-:33])=[O:34]>>[c:2]1([NH:14][CH2:15][CH2:16][N:17]2[CH2:18][CH2:19][N:20]([c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[CH2:21][CH2:22]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-f5bf23c4faba40c4a4dd5469a6cfcf4e
- 출처 데이터셋
- Test data from https://doi.org/10.1039/C8SC04228D
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