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Sodium Ion → N-[3-(7,8-Dimethoxy-1,3,4,5-tetrahydro-2H-3-benzazepin-2-on-3-yl)-propyl]-2-(3,4-dimethoxyphenylamino)-ethylamine

HRID 179705
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인쇄 미리보기

반응식

HRID 179705 반응식
[CH2:37]([Cl:38])[Cl:39].[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([cH:17][c:18]1[O:19][CH3:20])[CH2:7][C:8](=[O:16])[N:9]([CH2:12][CH2:13][CH2:14][Cl:15])[CH2:10][CH2:11]2.[CH3:21][O:22][c:23]1[cH:24][c:25]([NH:31][CH2:32][CH2:33][NH2:34])[cH:26][cH:27][c:28]1[O:29][CH3:30].[Na+:36].[OH-:35]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([cH:17][c:18]1[O:19][CH3:20])[CH2:7][C:8](=[O:16])[N:9]([CH2:12][CH2:13][CH2:14][NH:34][CH2:33][CH2:32][NH:31][c:25]1[cH:24][c:23]([O:22][CH3:21])[c:28]([O:29][CH3:30])[cH:27][cH:26]1)[CH2:10][CH2:11]2
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참가 물질

6

반응물 5

HCID 923Sodium IonHCID 961HydroxideHCID 6344DichloromethaneHCID 130925103-(3-Chloropropyl)-7,8-dimethoxy-1,3,4,5-tetrahydro-2H-3-benzazepin-2-oneHCID 135796642-(3,4-Dimethoxyphenylamino)-ethylamine

생성물 1

HCID 13579665N-[3-(7,8-Dimethoxy-1,3,4,5-tetrahydro-2H-3-benzazepin-2-on-3-yl)-propyl]-2-(3,4-dimethoxyphenylamino)-ethylamine

출처 및 근거

ORD 기록
ord-90c400a440f346f3853aa9d27c89972f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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