Hydrochloric Acid → 2-fluoro-5-nitro-N-(1,3-benzodioxol-5-ylmethyl)benzamide

HRID 137794

반응식

HRID 137794 반응식
[CH3:26][N:27]([CH3:28])[CH2:29][CH2:30][CH2:31][N:32]=[C:33]=[N:34][CH2:35][CH3:36].[CH3:47][N:48]([CH3:49])[CH:50]=[O:51].[ClH:25].[F:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][c:8]([N+:11](=[O:12])[O-:13])[cH:9][cH:10]1.[O:14]1[CH2:15][O:16][c:17]2[c:18]1[cH:19][cH:20][c:21]([CH2:23][NH2:24])[cH:22]2.[OH:37][n:38]1[c:39]2[cH:40][cH:41][cH:42][cH:43][c:44]2[n:45][n:46]1>>[F:1][c:2]1[c:3]([C:4](=[O:6])[NH:24][CH2:23][c:21]2[cH:20][cH:19][c:18]3[c:17]([cH:22]2)[O:16][CH2:15][O:14]3)[cH:7][c:8]([N+:11](=[O:12])[O-:13])[cH:9][cH:10]1

참가 물질

7

출처 및 근거

ORD 기록
ord-59745ef6e216424cb8b453b7afd00b2d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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