Sodium ion → 2-(3,5-Dichloro-4-hydroxyphenyl)-2-(3,5-dichloro-4-cyanatophenyl)-propane

HRID 2317259

반응식

HRID 2317259 반응식
[C:25](=[O:26])([O-:27])[O-:28].[CH2:34]([Cl:35])[Cl:36].[Cl:1][c:2]1[cH:3][c:4]([C:10]([CH3:11])([CH3:12])[c:13]2[cH:14][c:15]([Cl:21])[c:16]([OH:20])[c:17]([Cl:19])[cH:18]2)[cH:5][c:6]([Cl:9])[c:7]1[OH:8].[N:22]#[C:23][Cl:24].[Na+:29].[Na+:30].[Na+:32].[OH-:31].[OH2:33]>>[Cl:1][c:2]1[cH:3][c:4]([C:10]([CH3:11])([CH3:12])[c:13]2[cH:14][c:15]([Cl:21])[c:16]([O:20][C:23]#[N:22])[c:17]([Cl:19])[cH:18]2)[cH:5][c:6]([Cl:9])[c:7]1[OH:8]

참가 물질

8

출처 및 근거

ORD 기록
ord-a83f35a9a3754479880100d2b1e32605
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

연결된 노트

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