Toluene → HCID 18367277, compound

HRID 1214337Notes

Reaction equation

HRID 1214337 reaction equation
[CH3:1][O:2][c:3]1[c:4]2[c:9]([cH:10][cH:11][cH:12]1)[C:8](=[O:13])[CH2:7][CH2:6][CH2:5]2.[CH3:45][c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1.[c:14]1(-[c:20]2[n:21][c:22]([CH:31]([CH3:32])[NH2:33])[o:23][c:24]2-[c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[cH:15][cH:16][cH:17][cH:18][cH:19]1.[c:34]1([CH3:35])[cH:36][cH:37][c:38]([S:39]([OH:40])(=[O:41])=[O:42])[cH:43][cH:44]1>>[CH3:1][O:2][c:3]1[c:4]2[c:9]([cH:10][cH:11][cH:12]1)[CH:8]([NH:33][CH:31]([c:22]1[n:21][c:20](-[c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[c:24](-[c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[o:23]1)[CH3:32])[CH2:7][CH2:6][CH2:5]2

Participants

5

Reactant 4

HCID 1140TolueneHCID 6101p-Toluenesulfonic acidHCID 366205-MethoxytetraloneHCID 541979HCID 541979, compound

Product 1

HCID 18367277HCID 18367277, compound

Sources & evidence

ORD record
ord-a244e5d301a34a32a5e5fe9a841828b3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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