N,N-Bis(2-chloroethyl)-1-butanamine → 1-Butyl4-[4-(3-methyl-butoxy)-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][CH2:17][CH:18]([CH3:19])[CH3:20])[cH:13][cH:14]1)=[O:21].[CH2:22]([CH2:23][CH2:24][CH3:25])[N:26]([CH2:27][CH2:28][Cl:32])[CH2:30][CH2:31][Cl:29]>>[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][CH2:17][CH:18]([CH3:19])[CH3:20])[cH:13][cH:14]2)[CH2:28][CH2:27][N:26]([CH2:22][CH2:23][CH2:24][CH3:25])[CH2:30][CH2:31]1)=[O:21]참가 물질
3
출처 및 근거
- ORD 기록
- ord-32fd2192c0b647be90a9b67b4239c736
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
반응 노트
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