Bicarbonate Ion → 1-{4-[4-(2-Hydroxyethyl)anilino]-3-nitrophenyl}ethanone

HRID 171191

반응식

HRID 171191 반응식
[Cl:1][c:2]1[c:3]([N+:11](=[O:12])[O-:13])[cH:4][c:5]([C:8]([CH3:9])=[O:10])[cH:6][cH:7]1.[NH2:14][c:15]1[cH:16][cH:17][c:18]([CH2:21][CH2:22][OH:23])[cH:19][cH:20]1.[Na+:28].[O-:24][C:25]([OH:26])=[O:27].[O:30]=[CH:31][N:32]([CH3:33])[CH3:34].[OH2:29]>>[c:2]1([NH:14][c:15]2[cH:16][cH:17][c:18]([CH2:21][CH2:22][OH:23])[cH:19][cH:20]2)[c:3]([N+:11](=[O:12])[O-:13])[cH:4][c:5]([C:8]([CH3:9])=[O:10])[cH:6][cH:7]1

참가 물질

7

출처 및 근거

ORD 기록
ord-622d52f5f1434be38e08d102101ce4c4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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