HRID113221

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID8083

Morpholine

C4H9NO

HCID23938

Palladium

2 次

HCID95417

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

C17H14O

3 次

HCID522679

4-Bromo-2-methyl-6-nitroaniline

C7H7BrN2O2

HCID2734215

2-(Di-tert-butylphosphino)biphenyl

C20H27P

HCID4574913

未命名化合物

PRODUCTS

生成物

HCID11601132

2-Methyl-4-(morpholin-4-yl)-6-nitroaniline

C11H15N3O3

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2188ebd19fc340d08b291576d60a7c4d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[Br:28][c:29]1[cH:30][c:31]([CH3:39])[c:32]([NH2:33])[c:34]([N+:36](=[O:37])[O-:38])[cH:35]1.[C:1]([P:2]([C:3]([CH3:4])([CH3:5])[CH3:6])[c:7]1[cH:8][cH:9][cH:10][cH:11][c:12]1-[c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)([CH3:19])([CH3:20])[CH3:21].[CH2:102]1[O:103][CH2:104][CH2:105][CH2:106]1.[CH2:40]1[CH2:41][O:42][CH2:43][CH2:44][NH:45]1.[CH3:22][C:23]([CH3:24])([O-:25])[CH3:26].[Na+:27].[O:48]=[C:49]([CH:50]=[CH:51][c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1)[CH:58]=[CH:59][c:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1.[O:66]=[C:67]([CH:68]=[CH:69][c:70]1[cH:71][cH:72][cH:73][cH:74][cH:75]1)[CH:76]=[CH:77][c:78]1[cH:79][cH:80][cH:81][cH:82][cH:83]1.[O:84]=[C:85]([CH:86]=[CH:87][c:88]1[cH:89][cH:90][cH:91][cH:92][cH:93]1)[CH:94]=[CH:95][c:96]1[cH:97][cH:98][cH:99][cH:100][cH:101]1.[Pd:46].[Pd:47]>>[c:29]1([N:45]2[CH2:40][CH2:41][O:42][CH2:43][CH2:44]2)[cH:30][c:31]([CH3:39])[c:32]([NH2:33])[c:34]([N+:36](=[O:37])[O-:38])[cH:35]1