HRID135947

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID11776

Triphenylphosphine

C18H15P

HCID75555

未命名化合物

HCID59321540

Methyl 6-(4-hydroxyphenyl)-2-quinolinecarboxylate

C17H13NO3

HCID59321566

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc2cc(-c3ccc(OCc4c(-c5c(Cl)cncc5Cl)noc4C4CCC4)cc3)ccc2n1

HCID59321527

Methyl 6-[4-({[5-cyclobutyl-3-(3,5-dichloro-4-pyridinyl)-4-isoxazolyl]methyl}oxy)phenyl]-2-quinolinecarboxylate

C30H23Cl2N3O4

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c9201b9ce28b4d0e86a4e3bee126cb54
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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