O-Xylene → HCID 22502927, compound

HRID 1235666Notes

Reaction equation

HRID 1235666 reaction equation
[Br:27][c:28]1[n:29][c:30]([N:38]2[CH2:39][CH2:40][N:41]([CH2:44][CH3:45])[CH2:42][CH2:43]2)[c:31]2[cH:32][cH:33][cH:34][cH:35][c:36]2[cH:37]1.[CH3:1][CH:2]([C:3](=[O:4])[O:5][CH3:6])[CH2:7][c:8]1[cH:9][cH:10][c:11]([Sn:14]([CH2:15][CH2:16][CH2:17][CH3:18])([CH2:19][CH2:20][CH2:21][CH3:22])[CH2:23][CH2:24][CH2:25][CH3:26])[cH:12][cH:13]1.[CH3:54][CH2:55][O:56][C:57](=[O:58])[CH3:59].[c:46]1([CH3:47])[c:48]([CH3:49])[cH:50][cH:51][cH:52][cH:53]1>>[CH3:1][CH:2]([C:3](=[O:4])[O:5][CH3:6])[CH2:7][c:8]1[cH:9][cH:10][c:11](-[c:28]2[n:29][c:30]([N:38]3[CH2:39][CH2:40][N:41]([CH2:44][CH3:45])[CH2:42][CH2:43]3)[c:31]3[cH:32][cH:33][cH:34][cH:35][c:36]3[cH:37]2)[cH:12][cH:13]1

Participants

5

Reactant 4

HCID 7237O-XyleneHCID 8857Ethyl AcetateHCID 225024471-(1-Ethylpiperazin-4-yl)-3-bromoisoquinolineHCID 22502975HCID 22502975, compound

Product 1

HCID 22502927HCID 22502927, compound

Sources & evidence

ORD record
ord-16634ca12ef04613b2abdbd575a443ac
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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