HRID691238

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID1140

Toluene

C7H8

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID24290

未命名化合物

结构：C=[C](OCC)[Sn]([CH2]CCC)([CH2]CCC)[CH2]CCC

HCID619414

Tributyl(1-ethoxyvinyl)stannane

C16H34OSn

结构：O=C(NC1CCCN2c3cc(Br)ccc3Oc3ccccc3C12)C(F)(F)F

HCID72259783

未命名化合物

PRODUCTS

生成物

结构：CC(=O)c1ccc2c(c1)N1CCCC(NC(=O)C(F)(F)F)C1c1ccccc1O2

HCID87537321

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f7a2a6a886bb4d3ab423b5a1d30c3a2c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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