Ethanol → Ethyl N-tert-butoxycarbonyl-4-(3-methane-sulfonylaminobenzyl)piperidine-4-carboxylate

반응식

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([C:14](=[O:15])[O:16][CH2:17][CH3:18])([CH2:19][c:20]2[cH:21][c:22]([N+:26]([O-:27])=[O:28])[cH:23][cH:24][cH:25]2)[CH2:12][CH2:13]1.[CH3:29][S:30]([Cl:31])(=[O:32])=[O:33].[CH3:34][CH2:35][OH:36]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([C:14](=[O:15])[O:16][CH2:17][CH3:18])([CH2:19][c:20]2[cH:21][c:22]([NH:26][S:30]([CH3:29])(=[O:32])=[O:33])[cH:23][cH:24][cH:25]2)[CH2:12][CH2:13]1

참가 물질

반응물 3

HCID 702Ethanol

HCID 31297Methanesulfonyl chloride

HCID 53931544ethyl N-tert-butoxycarbonyl-4-(3-nitrobenzyl)piperidine-4-carboxylate

생성물 1

HCID 21193321Ethyl N-tert-butoxycarbonyl-4-(3-methane-sulfonylaminobenzyl)piperidine-4-carboxylate

출처 및 근거

ORD 기록: ord-b0a66842c9a049b2987b07317445fd68
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

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