Acetic Acid → 5-Methoxy-9-(4-methoxy-benzyloxy)-6,7-dihydro-pyrrolo[3,4-g]quinolin-8-one

HRID 156999Notes

Reaction equation

HRID 156999 reaction equation
[C:1](=[O:2])([O-:3])[O-:4].[CH3:65][C:66](=[O:67])[OH:68].[CH3:7][O:8][c:9]1[cH:10][cH:11][c:12]([CH2:13][Cl:14])[cH:15][cH:16]1.[F:36][c:37]1[cH:38][cH:39][c:40]([CH2:41][N:42]2[C:43](=[O:44])[c:45]3[c:46]([O:47][CH2:48][O:49][CH3:50])[c:51]4[c:52]([cH:53][cH:54][cH:55][n:56]4)[c:57]([O:58][CH3:59])[c:60]3[C:61]2=[O:62])[cH:63][cH:64]1.[I-:18].[K+:5].[K+:6].[Na+:17].[OH:19][c:20]1[c:21]2[c:22]([c:23]([O:30][CH3:31])[c:24]3[cH:25][cH:26][cH:27][n:28][c:29]13)[CH2:32][NH:33][C:34]2=[O:35]>>[CH3:7][O:8][c:9]1[cH:10][cH:11][c:12]([CH2:13][O:19][c:20]2[c:21]3[c:22]([c:23]([O:30][CH3:31])[c:24]4[cH:25][cH:26][cH:27][n:28][c:29]24)[CH2:32][NH:33][C:34]3=[O:35])[cH:15][cH:16]1

Participants

9

Reactant 8

HCID 176Acetic AcidHCID 813Potassium Cation2×HCID 923Sodium ionHCID 19660Carbonate IonHCID 30165Iodide IonHCID 699934-Methyloxybenzyl chlorideHCID 589286969-Hydroxy-5-methoxy-6,7-dihydro-pyrrolo[3,4-g]quinolin-8-oneHCID 589288257-(4-Fluoro-benzyl)-5-methoxy-9-methoxymethoxy-pyrrolo[3,4-g]quinoline-6,8-dione

Product 1

HCID 589287845-Methoxy-9-(4-methoxy-benzyloxy)-6,7-dihydro-pyrrolo[3,4-g]quinolin-8-one

Sources & evidence

ORD record
ord-5a71baaee0284e23af614b3b03cf1b9c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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