Toluene → HCID 22025412, 화합물

반응식

[CH3:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[Cl:1][c:2]1[cH:3][c:4]([C:11](=[O:12])[NH:13][CH2:14][CH2:15][C:16]([F:17])([F:18])[F:19])[c:5]([C:6](=[O:7])[OH:8])[cH:9][cH:10]1.[c:20]1([CH3:21])[cH:22][cH:23][c:24]([S:25]([OH:26])(=[O:27])=[O:28])[cH:29][cH:30]1>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]([cH:9][cH:10]1)[C:6](=[O:7])[N:13]([CH2:14][CH2:15][C:16]([F:17])([F:18])[F:19])[C:11]2=[O:12]

참가 물질

반응물 3

HCID 1140Toluene

HCID 6101p-Toluenesulfonic acid

HCID 22025467HCID 22025467, 화합물

생성물 1

HCID 22025412HCID 22025412, 화합물

출처 및 근거

ORD 기록: ord-e79697b05eaf4cf28eff76502154ec20
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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