Toluene → 2-(2,4-dimethoxybenzylamino)carbonyl-3-(4-nitrophenyl)-1H-pyrrole

HRID 692295

반응식

HRID 692295 반응식
[CH3:13][Al:14]([CH3:15])[CH3:16].[CH3:1][O:2][c:3]1[c:4]([CH2:5][NH2:6])[cH:7][cH:8][c:9]([O:11][CH3:12])[cH:10]1.[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[CH3:48][C:49]#[N:50].[N+:17](=[O:18])([O-:19])[c:20]1[cH:21][cH:22][c:23](-[c:26]2[c:27]([C:31](=[O:32])[O:33][CH3:34])[nH:28][cH:29][cH:30]2)[cH:24][cH:25]1>>[CH3:1][O:2][c:3]1[c:4]([CH2:5][NH:6][C:31]([c:27]2[c:26](-[c:23]3[cH:22][cH:21][c:20]([N+:17](=[O:18])[O-:19])[cH:25][cH:24]3)[cH:30][cH:29][nH:28]2)=[O:32])[cH:7][cH:8][c:9]([O:11][CH3:12])[cH:10]1

참가 물질

7

출처 및 근거

ORD 기록
ord-47b2724bab85475ab943f1eb8ffd354d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

연결된 노트

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