4-Chloro-3-hydroxyphenylacetic acid → {4-Chloro-3-[2-cyano-4-(ethylsulfonyl)phenoxy]phenyl}acetic acid

HRID 195293

반응식

HRID 195293 반응식
[Cl:15][c:16]1[c:17]([OH:26])[cH:18][c:19]([CH2:22][C:23](=[O:24])[OH:25])[cH:20][cH:21]1.[Cl:1][c:2]1[c:3]([C:4]#[N:5])[cH:6][c:7]([S:10](=[O:11])(=[O:12])[CH2:13][CH3:14])[cH:8][cH:9]1>>[c:2]1([O:26][c:17]2[c:16]([Cl:15])[cH:21][cH:20][c:19]([CH2:22][C:23](=[O:24])[OH:25])[cH:18]2)[c:3]([C:4]#[N:5])[cH:6][c:7]([S:10](=[O:11])(=[O:12])[CH2:13][CH3:14])[cH:8][cH:9]1

참가 물질

3

반응물 2

HCID 30171834-Chloro-3-hydroxyphenylacetic acidHCID 673903892-Chloro-5-(ethylsulfonyl)benzonitrile

생성물 1

HCID 16122987{4-Chloro-3-[2-cyano-4-(ethylsulfonyl)phenoxy]phenyl}acetic acid

출처 및 근거

ORD 기록
ord-ff9febd2f2b7407b985d9f7aa6d94f83
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

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