Dichloromethane → 3-(6-(5-cyclopentylbenzofuran-2-yl)-3,4-dihydroisoquinolin-2(1H)-yl)propanoic acid

반응식

[CH:1]1([c:6]2[cH:7][cH:8][c:9]3[c:10]([cH:11][c:12](-[c:14]4[cH:15][c:16]5[c:21]([cH:22][cH:23]4)[CH2:20][N:19]([CH2:24][CH2:25][C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])[CH2:18][CH2:17]5)[o:13]3)[cH:33]2)[CH2:2][CH2:3][CH2:4][CH2:5]1.[Cl:41][CH2:42][Cl:43].[F:34][C:35]([F:36])([F:37])[C:38]([OH:39])=[O:40]>>[CH:1]1([c:6]2[cH:7][cH:8][c:9]3[c:10]([cH:11][c:12](-[c:14]4[cH:15][c:16]5[c:21]([cH:22][cH:23]4)[CH2:20][N:19]([CH2:24][CH2:25][C:26](=[O:27])[OH:28])[CH2:18][CH2:17]5)[o:13]3)[cH:33]2)[CH2:2][CH2:3][CH2:4][CH2:5]1

참가 물질

반응물 3

HCID 6344Dichloromethane

HCID 6422Trifluoroacetic acid

HCID 59595930Tert-butyl 3-(6-(5-cyclopentylbenzofuran-2-yl)-3,4-dihydroisoquinolin-2(1H)-yl)propanoate

생성물 1

HCID 167375173-(6-(5-cyclopentylbenzofuran-2-yl)-3,4-dihydroisoquinolin-2(1H)-yl)propanoic acid

출처 및 근거

ORD 기록: ord-b1fe2eb8963a43808f601e2f34b22ffa
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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