Toluene → HCID 17967911, compound

HRID 171895Notes

Reaction equation

HRID 171895 reaction equation
[CH3:1][O:2][C:3](=[O:4])[CH:5]1[N:6]([S:13](=[O:14])(=[O:15])[c:16]2[cH:17][cH:18][c:19]([O:22][CH2:23][c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[cH:20][cH:21]2)[CH2:7][C:8]([CH3:11])([OH:12])[CH2:9][CH2:10]1.[CH3:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[CH3:48][CH2:49][O:50][C:51](=[O:52])[CH3:53].[c:30]1([CH3:31])[cH:32][cH:33][c:34]([S:35]([OH:36])(=[O:37])=[O:38])[cH:39][cH:40]1>>[O:2]=[C:3]1[CH:5]2[N:6]([S:13](=[O:14])(=[O:15])[c:16]3[cH:17][cH:18][c:19]([O:22][CH2:23][c:24]4[cH:25][cH:26][cH:27][cH:28][cH:29]4)[cH:20][cH:21]3)[CH2:7][C:8]([CH3:11])([CH2:9][CH2:10]2)[O:12]1

Participants

5

Reactant 4

HCID 1140TolueneHCID 6101p-Toluenesulfonic acidHCID 8857Ethyl AcetateHCID 54329089HCID 54329089, compound

Product 1

HCID 17967911HCID 17967911, compound

Sources & evidence

ORD record
ord-21c69971415246bdadf3b2e994a24ac7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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