HRID1124137

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8857

Ethyl acetate

C4H8O2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID15540

Benzenesulfonyl chloride, 2-nitro-

C6H4ClNO4S

HCID81531

Diisopropylethylamine

C8H19N

结构：C=CCOC1CC(C=C(C)C2OC(=O)C3CCCCN3C(=O)C(=O)C3(O)OC(C(OC)CC(C)CC(C)=CC(CC)C(=O)CC(O[Si](C)(C)C(C)(C)C)C2C)C(OC)CC3C)CCC1O

HCID56975637

未命名化合物

PRODUCTS

生成物

结构：C=CCOC1CC(C=C(C)C2OC(=O)C3CCCCN3C(=O)C(=O)C3(O)OC(C(OC)CC(C)CC(C)=CC(CC)C(=O)CC(O[Si](C)(C)C(C)(C)C)C2C)C(OC)CC3C)CCC1OS(=O)(=O)c1ccccc1[N+](=O)[O-]

HCID57086271

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-96a4c21dffb0494a931c1ac78ee88bdf
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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