HRID2139299

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID460

2-Methoxyphenol

C7H8O2

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

HCID75555

未命名化合物

结构：CC(=O)N1C(Cc2cc(F)cc(F)c2)C(C2CC(O)CN2C(=O)OC(C)(C)C)OC1(C)C

HCID77558581

未命名化合物

PRODUCTS

生成物

结构：COc1ccccc1OC1CC(C2OC(C)(C)N(C(C)=O)C2Cc2cc(F)cc(F)c2)N(C(=O)OC(C)(C)C)C1

HCID77559015

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e7b096e34b8d42e58fbac6ab2caec5ef
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:15]([CH3:16])([CH3:17])([CH3:18])[O:19][C:20](=[O:21])[N:22]1[CH:23]([CH:28]2[CH:29]([CH2:38][c:39]3[cH:40][c:41]([F:46])[cH:42][c:43]([F:45])[cH:44]3)[N:30]([C:35]([CH3:36])=[O:37])[C:31]([CH3:33])([CH3:34])[O:32]2)[CH2:24][CH:25]([OH:27])[CH2:26]1.[CH3:47][O:48][c:49]1[c:50]([OH:55])[cH:51][cH:52][cH:53][cH:54]1.[O:1]=[C:2]([O:3][CH:4]([CH3:5])[CH3:6])[N:7]=[N:8][C:9]([O:10][CH:11]([CH3:12])[CH3:13])=[O:14].[O:75]1[CH2:76][CH2:77][CH2:78][CH2:79]1.[c:56]1([P:57]([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[cH:70][cH:71][cH:72][cH:73][cH:74]1>>[C:15]([CH3:16])([CH3:17])([CH3:18])[O:19][C:20](=[O:21])[N:22]1[CH:23]([CH:28]2[CH:29]([CH2:38][c:39]3[cH:40][c:41]([F:46])[cH:42][c:43]([F:45])[cH:44]3)[N:30]([C:35]([CH3:36])=[O:37])[C:31]([CH3:33])([CH3:34])[O:32]2)[CH2:24][CH:25]([O:27][c:50]2[c:49]([O:48][CH3:47])[cH:54][cH:53][cH:52][cH:51]2)[CH2:26]1