3-(3-Methoxyphenoxy)-propyl chloride → 3-[(N-(3-(3-Methoxy-phenoxy)-propyl)-piperidin-3-yl)methyl]-7,8-methylenedioxy-1,3,4, 5-tetrahydro-2H-3-benzazepin-2-one

반응식

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

참가 물질

반응물 2

HCID 167929103-(3-Methoxyphenoxy)-propyl chloride

HCID 543405853-[(piperidin-3-yl)-methyl]-7,8-methylenedioxy-1,3,4,5-tetrahydro-2H-3-benzazepin-2-one

생성물 1

HCID 198036863-[(N-(3-(3-Methoxy-phenoxy)-propyl)-piperidin-3-yl)methyl]-7,8-methylenedioxy-1,3,4, 5-tetrahydro-2H-3-benzazepin-2-one

출처 및 근거

ORD 기록: ord-85673517dcfc4fb6bdd7c9b4376e91d7
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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