HRID90758

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID813

Potassium cation

K+

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID12679

Hexamethylphosphoramide

C6H18N3OP

HCID17944

Benzoyl chloride, 2,3-dichloro-

C7H3Cl3O

HCID3280088

未命名化合物

HCID19438809

未命名化合物

PRODUCTS

生成物

结构：COc1ccc2c(c1)c(CCN1CCOCC1)c(C)n2C(=O)c1cccc(Cl)c1Cl

HCID9911463

(2,3-Dichlorophenyl)[5-methoxy-2-methyl-3-[2-(4-morpholinyl)ethyl]-1H-indol-1-yl]methanone

C23H24Cl2N2O3

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9794a3b31c3f4ccbbf4821fc3587fe88
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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