HRID2122438

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

结构：CCOC(=O)Cc1c(C)n(Cc2cccc(OCc3ccccc3)c2)c2ccc(OC)cc12

HCID10503415

未命名化合物

HCID10729163

Ethyl (5-methoxy-2-methyl-1H-indol-3-yl)acetate

C14H17NO3

HCID13173490

1-(Benzyloxy)-3-(chloromethyl)benzene

C14H13ClO

PRODUCTS

生成物

结构：COc1ccc2c(c1)c(CC(=O)O)c(C)n2Cc1cccc(OCc2ccccc2)c1

HCID23368763

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-36b9d64b9df04e538e439a0b2120bc0f
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

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