HRID282422

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID1140

Toluene

C7H8

HCID6847

1-Naphthoic acid

C11H8O2

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID79205

2-Bromo-6-methylpyridine

C6H6BrN

HCID104815

Cuprous ion

Cu+

HCID104967

Cesium(1+)

Cs+

HCID119047

Phenoxide

C6H5O-

HCID2758875

Trifluoromethanesulfonate

CF3O3S-

HCID11858998

2-Hydroxy-4-methoxy-5-(2-thienyl)benzaldehyde

C12H10O3S

PRODUCTS

生成物

结构：COc1cc(Oc2cccc(C)n2)c(C=O)cc1-c1cccs1

HCID21981018

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4896d2b6741b442787a98a9d8988418c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

反应 SMILES

[Br:17][c:18]1[n:19][c:20]([CH3:24])[cH:21][cH:22][cH:23]1.[C:38](=[O:39])([O-:40])[O-:41].[CH3:51][c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1.[CH3:60][CH2:61][O:62][C:63](=[O:64])[CH3:65].[Cs+:42].[Cs+:43].[Cu+:80].[Na+:59].[O-:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[OH-:58].[OH:1][c:2]1[c:3]([CH:4]=[O:5])[cH:6][c:7](-[c:12]2[s:13][cH:14][cH:15][cH:16]2)[c:8]([O:10][CH3:11])[cH:9]1.[OH:25][C:26]([c:27]1[c:28]2[c:29]([cH:30][cH:31][cH:32][cH:33]2)[cH:34][cH:35][cH:36]1)=[O:37].[S:72]([O-:73])([C:74]([F:75])([F:76])[F:77])(=[O:78])=[O:79].[cH:66]1[cH:67][cH:68][cH:69][cH:70][cH:71]1>>[O:1]([c:2]1[c:3]([CH:4]=[O:5])[cH:6][c:7](-[c:12]2[s:13][cH:14][cH:15][cH:16]2)[c:8]([O:10][CH3:11])[cH:9]1)[c:18]1[n:19][c:20]([CH3:24])[cH:21][cH:22][cH:23]1