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Methanol → 4-[4-[2-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]ethyl]anilino]-N-octylpiperidine-1-carboxamide

HRID 303003
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인쇄 미리보기

반응식

HRID 303003 반응식
[CH3:38][OH:39].[CH:40]([Cl:41])([Cl:42])[Cl:43].[Cl:28][c:29]1[cH:30][c:31]([CH:35]2[O:36][CH2:37]2)[cH:32][cH:33][cH:34]1.[NH2:1][CH2:2][CH2:3][c:4]1[cH:5][cH:6][c:7]([NH:8][CH:9]2[CH2:10][CH2:11][N:12]([C:15](=[O:16])[NH:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH3:25])[CH2:13][CH2:14]2)[cH:26][cH:27]1>>[NH:1]([CH2:2][CH2:3][c:4]1[cH:5][cH:6][c:7]([NH:8][CH:9]2[CH2:10][CH2:11][N:12]([C:15](=[O:16])[NH:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH3:25])[CH2:13][CH2:14]2)[cH:26][cH:27]1)[CH2:37][CH:35]([c:31]1[cH:30][c:29]([Cl:28])[cH:34][cH:33][cH:32]1)[OH:36]
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 887MethanolHCID 6212ChloroformHCID 1556132-(3-Chlorophenyl)oxiraneHCID 181736624-[4-(2-Aminoethyl)anilino]-N-octyl-1-piperidinecarboxamide

생성물 1

HCID 1784436484-[4-[2-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]ethyl]anilino]-N-octylpiperidine-1-carboxamide

출처 및 근거

ORD 기록
ord-572d9a5580c34517b822d5fa77700a6c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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