5-(3-bromophenyl)-1H-1,2,3,4-tetrazole → {4-[5-(3-Bromophenyl)tetrazol-2-ylmethyl]phenoxy}acetic acid tert-butyl ester
반응식
[Br:1][c:2]1[cH:3][c:4](-[c:8]2[n:9][n:10][nH:11][n:12]2)[cH:5][cH:6][cH:7]1.[C:13]([CH3:14])([CH3:15])([CH3:16])[O:17][C:18]([CH2:19][O:20][c:21]1[cH:22][cH:23][c:24]([CH2:27][Br:28])[cH:25][cH:26]1)=[O:29]>>[Br:1][c:2]1[cH:3][c:4](-[c:8]2[n:9][n:10]([CH2:27][c:24]3[cH:23][cH:22][c:21]([O:20][CH2:19][C:18]([O:17][C:13]([CH3:14])([CH3:15])[CH3:16])=[O:29])[cH:26][cH:25]3)[n:11][n:12]2)[cH:5][cH:6][cH:7]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-fc91b22fb63d471faaf74189f145f7b8
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
반응 노트
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