Dichloromethane → 6,7-Dimethoxy-2-{[5-(4-methylphenyl)isoxazol-4-yl]carbonyl}-1,2,3,4-tetrahydroisoquinoline

반응식

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

참가 물질

반응물 3

HCID 6344Dichloromethane

HCID 156236,7-Dimethoxy-1,2,3,4-Tetrahydroisoquinoline

HCID 729429065-(P-tolyl)isoxazole-4-carbonyl chloride

생성물 1

HCID 591700716,7-Dimethoxy-2-{[5-(4-methylphenyl)isoxazol-4-yl]carbonyl}-1,2,3,4-tetrahydroisoquinoline

출처 및 근거

ORD 기록: ord-f3b68d84d0a749c4858a2acdc3a22f02
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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