Benzene → HCID 19759483, compound

HRID 204181Notes

Reaction equation

HRID 204181 reaction equation
[CH2:26]([N+:27]([CH2:28][CH2:29][CH2:30][CH3:31])([CH2:32][CH2:33][CH2:34][CH3:35])[CH2:36][CH2:37][CH2:38][CH3:39])[CH2:40][CH2:41][CH3:42].[CH3:15][I:16].[CH3:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([C:13]#[N:14])[cH:10][nH:11][cH:12]2)[cH:6][cH:7]1.[I-:25].[Na+:24].[OH-:23].[cH:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1>>[CH3:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([C:13]#[N:14])[cH:10][n:11]([CH3:15])[cH:12]2)[cH:6][cH:7]1

Participants

8

Sources & evidence

ORD record
ord-f896622e3a244d95be5eaabf98d4585d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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