Benzene → 1-[6,7-Dimethoxy-1-[(3,4,5-trimethoxyphenyl)methylidene]-3,4-dihydroisoquinolin-2-yl]-2-(3,4,5-trimethoxyphenyl)ethanone

HRID 2148097

Reaction equation

HRID 2148097 reaction equation
[CH2:23]([N:24]([CH2:25][CH3:26])[C:27]#[C:28][CH3:29])[CH3:30].[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:13][C:14](=[O:15])[OH:16])[cH:6][c:7]([O:11][CH3:12])[c:8]1[O:9][CH3:10].[CH3:31][O:32][c:33]1[cH:34][c:35]2[c:40]([cH:41][c:42]1[O:43][CH3:44])[C:39](=[CH:45][c:46]1[cH:47][c:48]([O:56][CH3:57])[c:49]([O:54][CH3:55])[c:50]([O:52][CH3:53])[cH:51]1)[NH:38][CH2:37][CH2:36]2.[cH:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1.[cH:58]1[cH:59][cH:60][n:61][cH:62][cH:63]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:13][C:14](=[O:16])[N:38]2[CH2:37][CH2:36][c:35]3[cH:34][c:33]([O:32][CH3:31])[c:42]([O:43][CH3:44])[cH:41][c:40]3[C:39]2=[CH:45][c:46]2[cH:47][c:48]([O:56][CH3:57])[c:49]([O:54][CH3:55])[c:50]([O:52][CH3:53])[cH:51]2)[cH:6][c:7]([O:11][CH3:12])[c:8]1[O:9][CH3:10]

Participants

6

Reactant 5

HCID 241BenzeneHCID 1049PyridineHCID 703723,4,5-Trimethoxyphenylacetic acidHCID 77909N,N-Diethyl-1-propyn-1-amineHCID 706389523,4-Dihydro-6,7-dimethoxy-1-[(3,4,5-trimethoxyphenyl)methylene]isoquinoline

Product 1

HCID 681230991-[6,7-Dimethoxy-1-[(3,4,5-trimethoxyphenyl)methylidene]-3,4-dihydroisoquinolin-2-yl]-2-(3,4,5-trimethoxyphenyl)ethanone

Sources & evidence

ORD record
ord-3f59ac4804ac4fb9aa72eec491485dbc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Linked notes

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