HRID804889

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID166653

Hydride

H-

结构：Cc1c(-c2ccc(OCc3ccccc3)cc2)[nH]c2ccc(OCc3ccccc3)cc12

HCID3824745

5-(Benzyloxy)-2-[4-(benzyloxy)phenyl]-3-methyl-1H-indole

C29H25NO2

HCID9882910

1-{2-[4-(Chloromethyl)phenoxy]ethyl}azepane

C15H22ClNO

PRODUCTS

生成物

结构：Cc1c(-c2ccc(OCc3ccccc3)cc2)n(Cc2ccc(OCCN3CCCCCC3)cc2)c2ccc(OCc3ccccc3)cc12

HCID9895831

1-[4-(2-AZEPAN-1-YL-ETHOXY)-BENZYL]-5-BENZYLOXY-2-(4-BENZYLOXY-PHENYL)-3-METHYL-1H-INDOLE

C44H46N2O3

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-78795f739f9643a3825fd036302697de
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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