Acetic Acid → 5-Methyl-2-nitro-3-phenylbenzofuran

HRID 139021

반응식

HRID 139021 반응식
[Br:1][c:2]1[o:3][c:4]2[c:5]([c:6]1-[c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1)[cH:13][c:14]([CH3:17])[cH:15][cH:16]2.[CH3:35][C:36](=[O:37])[OH:38].[CH:18]1=[CH:26][CH2:25][CH:21]([C:22]([OH:23])=[O:24])[CH2:20][CH2:19]1.[N:27](=[O:28])[O-:29].[Na+:30].[OH:31][N+:32](=[O:33])[O-:34]>>[c:2]1([N+:27](=[O:28])[O-:29])[o:3][c:4]2[c:5]([c:6]1-[c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1)[cH:13][c:14]([CH3:17])[cH:15][cH:16]2

참가 물질

7

출처 및 근거

ORD 기록
ord-fb740a39f10f4de586ec4bd5e4361c2d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

불러오는 중…