O-Xylene → HCID 54712693, compound

HRID 319103Notes

Reaction equation

HRID 319103 reaction equation
[NH2:19][c:20]1[cH:21][cH:22][c:23]([O:28][CH3:29])[c:24](=[O:27])[cH:25][cH:26]1.[OH:1][C:2]1=[C:3]([C:15]([O:17][CH3:16])=[O:18])[N:4]([CH3:14])[S:5](=[O:12])(=[O:13])[c:6]2[c:7]1[cH:8][cH:9][cH:10][cH:11]2.[c:30]1([CH3:31])[c:32]([CH3:33])[cH:34][cH:35][cH:36][cH:37]1>>[OH:1][C:2]1=[C:3]([C:15](=[O:17])[NH:19][c:20]2[cH:21][cH:22][c:23]([O:28][CH3:29])[c:24](=[O:27])[cH:25][cH:26]2)[N:4]([CH3:14])[S:5](=[O:12])(=[O:13])[c:6]2[c:7]1[cH:8][cH:9][cH:10][cH:11]2

Participants

4

Reactant 3

HCID 7237O-XyleneHCID 1354432,4,6-Cycloheptatrien-1-one, 5-amino-2-methoxy-HCID 54676532methyl 4-hydroxy-2-methyl-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide

Product 1

HCID 54712693HCID 54712693, compound

Sources & evidence

ORD record
ord-beb12eced70a4794afe594b4107f5e08
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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