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Dimethyl Sulfoxide → 1-[2-Ethyl-5-(ethyloxy)-4-nitrophenyl]-4-[2-(methylsulfonyl)ethyl]piperidine

HRID 2160454
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HRID 2160454 반응식
[CH2:1]([CH3:2])[c:3]1[c:4]([F:15])[cH:5][c:6]([O:12][CH2:13][CH3:14])[c:7]([N+:9](=[O:10])[O-:11])[cH:8]1.[CH3:16][S:17](=[O:18])(=[O:19])[CH2:20][CH2:21][CH:22]1[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]1.[CH3:34][S:35]([CH3:36])=[O:37].[K+:28].[K+:29].[O-:30][C:31]([O-:32])=[O:33].[OH2:38]>>[CH2:1]([CH3:2])[c:3]1[c:4]([N:25]2[CH2:24][CH2:23][CH:22]([CH2:21][CH2:20][S:17]([CH3:16])(=[O:18])=[O:19])[CH2:27][CH2:26]2)[cH:5][c:6]([O:12][CH2:13][CH3:14])[c:7]([N+:9](=[O:10])[O-:11])[cH:8]1
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참가 물질

7

반응물 6

HCID 679Dimethyl SulfoxideHCID 813Potassium Cation2회HCID 962WaterHCID 19660Carbonate IonHCID 594527154-[2-(Methylsulfonyl)ethyl]piperidineHCID 594528781-Ethoxy-4-ethyl-5-fluoro-2-nitrobenzene

생성물 1

HCID 594526821-[2-Ethyl-5-(ethyloxy)-4-nitrophenyl]-4-[2-(methylsulfonyl)ethyl]piperidine

출처 및 근거

ORD 기록
ord-c9b77f8173974c14b7ee0b2a480e9aee
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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