HRID682568

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID8028

Tetrahydrofuran

C4H8O

HCID82129

Carbonochloridic acid, 4-nitrophenyl ester

C7H4ClNO4

HCID18321046

3-(Piperidin-4-yl)quinolin-2(1H)-one

C14H16N2O

结构：COC(=O)C(O)Cc1cc(C)c(OCc2ccccc2)c(C)c1

HCID77257674

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(Cc1cc(C)c(OCc2ccccc2)c(C)c1)OC(=O)N1CCC(c2cc3ccccc3[nH]c2=O)CC1

HCID68676171

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-04d31a7d0ed541c4b8123daf24d33521
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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