Ethanol → 1,2,3,4-Tetrahydro-6-hydroxy-2-[4-(2-methoxyphenyl)-1-piperazinyl]-naphthalene

반응식

[CH3:28][CH2:29][OH:30].[Cl:1][CH2:2][CH2:3][N:4]([c:5]1[c:6]([O:11][CH3:12])[cH:7][cH:8][cH:9][cH:10]1)[CH2:13][CH2:14][Cl:15].[NH2:16][CH:17]1[CH2:18][c:19]2[cH:20][cH:21][c:22]([OH:27])[cH:23][c:24]2[CH2:25][CH2:26]1>>[CH2:2]1[CH2:3][N:4]([c:5]2[c:6]([O:11][CH3:12])[cH:7][cH:8][cH:9][cH:10]2)[CH2:13][CH2:14][N:16]1[CH:17]1[CH2:18][c:19]2[cH:20][cH:21][c:22]([OH:27])[cH:23][c:24]2[CH2:25][CH2:26]1

참가 물질

반응물 3

HCID 702Ethanol

HCID 227137n,n-Bis(2-chloroethyl)-2-methoxyaniline

HCID 131778796-Amino-5,6,7,8-tetrahydronaphthalen-2-OL

생성물 1

HCID 205568141,2,3,4-Tetrahydro-6-hydroxy-2-[4-(2-methoxyphenyl)-1-piperazinyl]-naphthalene

출처 및 근거

ORD 기록: ord-0731f8da2c7c4c23b8a0f9f972d079af
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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