HRID2160911

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

3 次

HCID1061

Phosphate

O4P-3

HCID6344

Dichloromethane

CH2Cl2

HCID8071

未命名化合物

HCID23938

Palladium

2 次

HCID95417

1,5-Diphenyl-1,4-pentadien-3-one

C17H14O

3 次

HCID2758519

3-(Dimethylamino)pyrrolidine

C6H14N2

HCID20744379

未命名化合物

PRODUCTS

生成物

结构：CC(NC(=O)OC(C)(C)C)c1cccc(N2CCC(N(C)C)C2)c1

HCID69588726

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d5addcd2ed7543a8840b30272745de01
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]([CH3:9])[c:10]1[cH:11][c:12]([Br:16])[cH:13][cH:14][cH:15]1)=[O:17].[CH2:40]([Cl:41])[Cl:42].[CH3:18][N:19]([CH:20]1[CH2:21][NH:22][CH2:23][CH2:24]1)[CH3:25].[CH3:34][O:35][CH2:36][CH2:37][O:38][CH3:39].[K+:31].[K+:32].[K+:33].[O:45]=[C:46]([CH:47]=[CH:48][c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1)[CH:55]=[CH:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1.[O:63]=[C:64]([CH:65]=[CH:66][c:67]1[cH:68][cH:69][cH:70][cH:71][cH:72]1)[CH:73]=[CH:74][c:75]1[cH:76][cH:77][cH:78][cH:79][cH:80]1.[O:81]=[C:82]([CH:83]=[CH:84][c:85]1[cH:86][cH:87][cH:88][cH:89][cH:90]1)[CH:91]=[CH:92][c:93]1[cH:94][cH:95][cH:96][cH:97][cH:98]1.[P:26]([O-:27])([O-:28])([O-:29])=[O:30].[Pd:43].[Pd:44]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]([CH3:9])[c:10]1[cH:11][c:12]([N:22]2[CH2:21][CH:20]([N:19]([CH3:18])[CH3:25])[CH2:24][CH2:23]2)[cH:13][cH:14][cH:15]1)=[O:17]