HRID682748

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID5943

Carbon tetrachloride

CCl4

HCID13551

Isopropyl methanesulfonate

C4H10O3S

HCID2758875

Trifluoromethanesulfonate

CF3O3S-

3 次

HCID4534583

未命名化合物

HCID22044199

未命名化合物

PRODUCTS

生成物

结构：CC(C)c1cc2c(c(O)c1-c1ccc3c(c1)CCCC3)CCCC2

HCID22044195

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2e8357538bc2433db03cd65eaf760b84
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[C:55]([Cl:56])([Cl:57])([Cl:58])[Cl:59].[CH3:22][S:23]([O:24][CH:27]([CH3:28])[CH3:29])(=[O:25])=[O:26].[S:30]([O-:31])([C:32]([F:33])([F:34])[F:35])(=[O:36])=[O:37].[S:39]([O-:40])([C:41]([F:42])([F:43])[F:44])(=[O:45])=[O:46].[S:47]([O-:48])([C:49]([F:50])([F:51])[F:52])(=[O:53])=[O:54].[Sc+3:38].[c:1]1([OH:21])[c:2](-[c:11]2[cH:12][c:13]3[c:18]([cH:19][cH:20]2)[CH2:17][CH2:16][CH2:15][CH2:14]3)[cH:3][cH:4][c:5]2[c:10]1[CH2:9][CH2:8][CH2:7][CH2:6]2>>[c:1]1([OH:21])[c:2](-[c:11]2[cH:12][c:13]3[c:18]([cH:19][cH:20]2)[CH2:17][CH2:16][CH2:15][CH2:14]3)[c:3]([CH:27]([CH3:28])[CH3:29])[cH:4][c:5]2[c:10]1[CH2:9][CH2:8][CH2:7][CH2:6]2