Chloroform → 4,4-Dimethyl-7-(2,4-dimethoxybenzoyl amino)-8-nitro-2H,4H-isoquinoline-1,3-dione

HRID 126320

반응식

HRID 126320 반응식
[CH3:1][C:2]1([CH3:18])[C:3](=[O:17])[NH:4][C:5](=[O:16])[c:6]2[c:7]([N+:13](=[O:14])[O-:15])[c:8]([NH2:12])[cH:9][cH:10][c:11]21.[CH3:23][O:24][c:25]1[c:26]([C:27](=[O:28])[Cl:29])[cH:30][cH:31][c:32]([O:34][CH3:35])[cH:33]1.[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[CH:19]([Cl:20])([Cl:21])[Cl:22]>>[CH3:1][C:2]1([CH3:18])[C:3](=[O:17])[NH:4][C:5](=[O:16])[c:6]2[c:7]([N+:13](=[O:14])[O-:15])[c:8]([NH:12][C:27]([c:26]3[c:25]([O:24][CH3:23])[cH:33][c:32]([O:34][CH3:35])[cH:31][cH:30]3)=[O:28])[cH:9][cH:10][c:11]21

참가 물질

5

출처 및 근거

ORD 기록
ord-b4a37ce4b94e415395e13574e75cf796
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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