Sodium ion → 2-Benzo[1,3]dioxol-5-ylmethyl-4-hydroxy-1,1-dioxo-1,2-dihydro-1lambda6-benzo[e][1,2]thiazine-3-carboxylic acid methyl ester

HRID 145845Notes

Reaction equation

HRID 145845 reaction equation
[CH2:20]1[O:21][c:22]2[cH:23][c:24]([CH2:25][Cl:26])[cH:27][cH:28][c:29]2[O:30]1.[CH3:1][O:2][C:3](=[O:4])[C:5]1=[C:10]([OH:11])[c:9]2[c:8]([cH:15][cH:14][cH:13][cH:12]2)[S:7](=[O:16])(=[O:17])[NH:6]1.[CH3:36][CH2:37][O:38][C:39](=[O:40])[CH3:41].[H-:18].[Na+:19].[O:31]=[CH:32][N:33]([CH3:34])[CH3:35]>>[CH3:1][O:2][C:3](=[O:4])[C:5]1=[C:10]([OH:11])[c:9]2[c:8]([cH:15][cH:14][cH:13][cH:12]2)[S:7](=[O:16])(=[O:17])[N:6]1[CH2:25][c:24]1[cH:23][c:22]2[c:29]([cH:28][cH:27]1)[O:30][CH2:20][O:21]2

Participants

7

Reactant 6

HCID 923Sodium ionHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 887131,3-Benzodioxole, 5-(chloromethyl)-HCID 166653HydrideHCID 54676531methyl 4-hydroxy-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide

Product 1

HCID 700589382-Benzo[1,3]dioxol-5-ylmethyl-4-hydroxy-1,1-dioxo-1,2-dihydro-1lambda6-benzo[e][1,2]thiazine-3-carboxylic acid methyl ester

Sources & evidence

ORD record
ord-d58897fed9b548feab07901ba7d7e450
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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