Ethanol → HCID 21073874, compound

HRID 194740Notes

Reaction equation

HRID 194740 reaction equation
[CH2:32]1[O:33][CH2:34][CH2:35][CH2:36]1.[CH3:37][CH2:38][OH:39].[Cl:1][c:2]1[c:3]([N:9]2[CH2:10][CH2:11][N:12]([CH2:15][CH2:16][CH2:17][CH:18]=[CH:19][c:20]3[cH:21][cH:22][c:23]4[cH:24][c:25]([CH3:31])[c:26](=[O:30])[nH:27][c:28]4[n:29]3)[CH2:13][CH2:14]2)[cH:4][cH:5][cH:6][c:7]1[Cl:8]>>[Cl:1][c:2]1[c:3]([N:9]2[CH2:10][CH2:11][N:12]([CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][c:20]3[cH:21][cH:22][c:23]4[cH:24][c:25]([CH3:31])[c:26](=[O:30])[nH:27][c:28]4[n:29]3)[CH2:13][CH2:14]2)[cH:4][cH:5][cH:6][c:7]1[Cl:8]

Participants

4

Sources & evidence

ORD record
ord-73c96e78209147d7bfaaadd8bf3cb4a9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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