O-Xylene → HCID 22452170, compound

HRID 1122233Notes

Reaction equation

HRID 1122233 reaction equation
[CH2:1]([O:3][C:4](=[O:2])[CH2:6][n:7]1[n:8][c:9](-[c:18]2[cH:19][cH:20][c:21]([O:24][CH3:25])[cH:22][cH:23]2)[cH:10][c:11]([C:14]([NH:15][CH3:16])=[O:17])[c:12]1=[O:13])[CH3:5].[NH2:26][CH2:27][c:28]1[n:29][cH:30][cH:31][cH:32][cH:33]1.[c:34]1([CH3:35])[c:36]([CH3:37])[cH:38][cH:39][cH:40][cH:41]1>>[O:3]=[C:4]([CH2:6][n:7]1[n:8][c:9](-[c:18]2[cH:19][cH:20][c:21]([O:24][CH3:25])[cH:22][cH:23]2)[cH:10][c:11]([C:14]([NH:15][CH3:16])=[O:17])[c:12]1=[O:13])[NH:26][CH2:27][c:28]1[n:29][cH:30][cH:31][cH:32][cH:33]1

Participants

4

Reactant 3

HCID 7237O-XyleneHCID 195092-PyridinemethanamineHCID 22452283HCID 22452283, compound

Product 1

HCID 22452170HCID 22452170, compound

Sources & evidence

ORD record
ord-4e2578f8447f49a3ad931751c28bbb53
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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