HRID2319449

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

HCID40895

2-Butanol, 1-methoxy-

C5H12O2

HCID220568

ethyl N-ethoxycarbonyliminocarbamate

C6H10N2O4

HCID7472028

methyl 3-(benzyloxy)-5-hydroxybenzoate

C15H14O4

PRODUCTS

生成物

结构：CCC(COC)Oc1cc(OCc2ccccc2)cc(C(=O)OC)c1

HCID67157669

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0a9ab2e9d4a54727bc42cc9d4cbc546e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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