Benzoic Acid → 6,7-Dimethoxy-1-(4-nitro-phenyl)-1,2,3,4-tetrahydro-isoquinoline

HRID 319507Notes

Reaction equation

HRID 319507 reaction equation
[OH:21][C:22]([c:23]1[cH:24][cH:25][c:26]([N+:30]([O-:31])=[O:32])[cH:27][cH:28]1)=[O:29].[OH:33][C:34]([c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)=[O:41].[c:1]1([CH:7]2[NH:8][CH2:9][CH2:10][c:11]3[cH:12][c:13]([O:19][CH3:20])[c:14]([O:17][CH3:18])[cH:15][c:16]32)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]2[NH:8][CH2:9][CH2:10][c:11]3[cH:12][c:13]([O:19][CH3:20])[c:14]([O:17][CH3:18])[cH:15][c:16]32)[cH:2][cH:3][c:4]([N+:30](=[O:31])[O-:32])[cH:5][cH:6]1

Participants

4

Reactant 3

HCID 243Benzoic AcidHCID 61084-Nitrobenzoic AcidHCID 1511866,7-Dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinoline

Product 1

HCID 6061536,7-Dimethoxy-1-(4-nitro-phenyl)-1,2,3,4-tetrahydro-isoquinoline

Sources & evidence

ORD record
ord-340fdfc7ac04411caf6c5eb8187befbd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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