HRID835558

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6212

Chloroform

CHCl3

HCID6344

Dichloromethane

CH2Cl2

HCID9834204

未命名化合物

结构：Cn1nnc(N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C2CCCNc3cc4c(cc32)COC4)n1

HCID72297451

未命名化合物

PRODUCTS

生成物

结构：Cn1nnc(N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C2CCCNc3c2cc2c(c3Br)COC2)n1

HCID72297426

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cc01f70182fe452f9a05804ea7df25f9
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[Br:37][NH:38][C:39](=[O:40])[CH2:41][CH2:42][C:43]([NH2:44])=[O:45].[C:46](=[O:47])([OH:48])[O-:49].[CH:52]([Cl:53])([Cl:54])[Cl:55].[Cl:56][CH2:57][Cl:58].[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][N:7]([c:8]2[n:9][n:10][n:11]([CH3:13])[n:12]2)[CH:14]2[CH2:15][CH2:16][CH2:17][NH:18][c:19]3[c:20]2[cH:21][c:22]2[c:26]([cH:27]3)[CH2:25][O:24][CH2:23]2)[cH:28][c:29]([C:31]([F:32])([F:33])[F:34])[cH:30]1)([F:35])[F:36].[Na+:50].[OH2:51]>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][N:7]([c:8]2[n:9][n:10][n:11]([CH3:13])[n:12]2)[CH:14]2[CH2:15][CH2:16][CH2:17][NH:18][c:19]3[c:20]2[cH:21][c:22]2[c:26]([c:27]3[Br:37])[CH2:25][O:24][CH2:23]2)[cH:28][c:29]([C:31]([F:32])([F:33])[F:34])[cH:30]1)([F:35])[F:36]