HRID211003

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID8027

Pyrrole

C4H5N

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

n-Hexane

C6H14

HCID8857

Ethyl acetate

C4H8O2

HCID28486

Lithium ion

Li+

HCID31275

1,4-Dioxane

C4H8O2

HCID69838

1-(Bromomethyl)-3-chlorobenzene

C7H6BrCl

HCID166653

Hydride

H-

HCID280229

1,5,6,7-Tetrahydro-4H-indol-4-one

C8H9NO

HCID2759784

Methyl benzenesulfinate

C7H8O2S

PRODUCTS

生成物

HCID22450621

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e77f07861f7542099a1b24764ecdf1e4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH3:51][CH2:52][CH2:53][CH2:54][CH2:55][CH3:56].[CH3:57][CH2:58][O:59][C:60](=[O:61])[CH3:62].[Cl:11][c:12]1[cH:13][c:14]([CH2:15][Br:16])[cH:17][cH:18][cH:19]1.[H-:25].[Li+:37].[Na+:26].[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1.[O:44]1[CH2:45][CH2:46][O:47][CH2:48][CH2:49]1.[OH-:38].[OH2:50].[c:27]1([S:28]([O:29][CH3:30])=[O:31])[cH:32][cH:33][cH:34][cH:35][cH:36]1.[nH:1]1[cH:2][cH:3][c:4]2[c:9]1[CH2:8][CH2:7][CH2:6][C:5]2=[O:10].[nH:20]1[cH:21][cH:22][cH:23][cH:24]1>>[n:1]1([CH2:15][c:14]2[cH:13][c:12]([Cl:11])[cH:19][cH:18][cH:17]2)[cH:2][cH:3][c:4]2[c:9]1[CH2:8][CH2:7][CH2:6][C:5]2=[O:10]