HRID1552948

反应详情

EQUATION

反应方程式

REACTANTS

反应物

反应SMILES：CC1(C)OB(c2ccc(OC(F)F)c(OC3CC3)c2)OC1(C)C

HCID66602834

未命名化合物

反应SMILES：CCOC(=O)c1c(Cc2ccc(OC)nc2)c(Br)n(COCc2ccccc2)c1C=O

HCID77230465

未命名化合物

PRODUCTS

产物

反应SMILES：CCOC(=O)c1c(Cc2ccc(OC)nc2)c(-c2ccc(OC(F)F)c(OC3CC3)c2)n(COCc2ccccc2)c1C=O

HCID86627051

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-381bf12e09c8462e85ed311c7ceadb6e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应SMILES

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