HRID2142214

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID1390

1-Methylimidazole

C4H6N2

HCID7360

Tetrahydrofurfuryl alcohol

C5H10O2

HCID8028

Tetrahydrofuran

C4H8O

反应SMILES：CC(C)c1cc(C(C)C)c(S(=O)(=O)Cl)c(C(C)C)c1

HCID81042

2,4,6-Triisopropylbenzenesulfonyl chloride

C15H23ClO2S

反应SMILES：COc1cc(OC)nc(Oc2ccccc2C(=O)O)n1

HCID184185

2-[(4,6-Dimethoxy-2-pyrimidinyl)oxy]benzoic acid

C13H12N2O5

PRODUCTS

产物

反应SMILES：COc1cc(OC)nc(Oc2ccccc2C(=O)OCC2CCCO2)n1

HCID15278238

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-515ea3e3c09648bfbb36258a38ee6e97
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

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