N-Benzylnormechlorethamine → 1-Benzyl-4-(4-but-2-ynyloxy-benzenesulfonyl)-piperidine-4-carboxylic acid ethyl ester
반응식
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][S:6](=[O:7])(=[O:8])[c:9]1[cH:10][cH:11][c:12]([O:15][CH2:16][C:17]#[C:18][CH3:19])[cH:13][cH:14]1)=[O:20].[Cl:21][CH2:22][CH2:23][N:24]([CH2:25][c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1)[CH2:32][CH2:33][Cl:34]>>[CH2:1]([CH3:2])[O:3][C:4]([C:5]1([S:6](=[O:7])(=[O:8])[c:9]2[cH:10][cH:11][c:12]([O:15][CH2:16][C:17]#[C:18][CH3:19])[cH:13][cH:14]2)[CH2:22][CH2:23][N:24]([CH2:25][c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[CH2:32][CH2:33]1)=[O:20]참가 물질
3
출처 및 근거
- ORD 기록
- ord-75cf77a0d1114bcbbf70e86ae2fd0f65
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
반응 노트
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