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1,2-Dichloroethane → Ethyl 5-[2-oxo-2-(2-phenylmethoxycarbonylpyrrolidin-1-yl)ethoxy]-1-phenylpyrazole-3-carboxylate

HRID 180463
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HRID 180463 반응식
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[n:7][n:8](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[c:9]([O:11][CH2:12][C:13](=[O:14])[OH:15])[cH:10]1.[CH2:42]([c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1)[O:49][C:50]([CH:51]1[NH:52][CH2:53][CH2:54][CH2:55]1)=[O:56].[CH2:62]([Cl:63])[CH2:64][Cl:65].[CH:32]([N:33]([CH2:34][CH3:35])[CH:36]([CH3:37])[CH3:38])([CH3:39])[CH3:40].[ClH:41].[O:57]=[CH:58][N:59]([CH3:60])[CH3:61].[OH:22][n:23]1[c:24]2[c:25]([cH:26][cH:27][cH:28][cH:29]2)[n:30][n:31]1>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[n:7][n:8](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[c:9]([O:11][CH2:12][C:13](=[O:15])[N:52]2[CH:51]([C:50]([O:49][CH2:42][c:43]3[cH:44][cH:45][cH:46][cH:47][cH:48]3)=[O:56])[CH2:55][CH2:54][CH2:53]2)[cH:10]1
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참가 물질

8

반응물 7

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 99767Proline benzyl esterHCID 668550565-Carboxymethoxy-1-phenyl-1H-pyrazole-3-carboxylic acid ethyl ester

생성물 1

HCID 66854980Ethyl 5-[2-oxo-2-(2-phenylmethoxycarbonylpyrrolidin-1-yl)ethoxy]-1-phenylpyrazole-3-carboxylate

출처 및 근거

ORD 기록
ord-e5dd09963b6f4ec9b60eaa95d9951a24
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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