Ethanol → Ethyl 4-amino-2-ethyl-6-(trifluoromethyl)-3,4-dihydroquinoline-1(2H)-carboxylate

반응식

[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH:7]([CH2:31][CH3:32])[CH2:8][CH:9]([NH:20][C:21]([O:22][CH2:23][c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)=[O:30])[c:10]2[cH:11][c:12]([C:16]([F:17])([F:18])[F:19])[cH:13][cH:14][c:15]21.[CH2:33]1[CH2:34][CH:35]=[CH:36][CH2:37][CH2:38]1.[CH3:39][CH2:40][OH:41]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH:7]([CH2:31][CH3:32])[CH2:8][CH:9]([NH2:20])[c:10]2[cH:11][c:12]([C:16]([F:17])([F:18])[F:19])[cH:13][cH:14][c:15]21

참가 물질

반응물 3

HCID 702Ethanol

HCID 8079Cyclohexene

HCID 69578498ethyl 2-ethyl-4-(phenylmethoxycarbonylamino)-6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carboxylate

생성물 1

HCID 9944755Ethyl 4-amino-2-ethyl-6-(trifluoromethyl)-3,4-dihydroquinoline-1(2H)-carboxylate

출처 및 근거

ORD 기록: ord-367fab8c241343dea01c605285b498b2
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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