Ethanol → HCID 15572606, compound

HRID 2333131Notes

Reaction equation

HRID 2333131 reaction equation
[CH2:25]1[O:26][CH2:27][CH2:28][CH2:29]1.[CH3:22][CH2:23][OH:24].[OH:1][CH:2]([C:3]#[N:4])[CH:5]([O:6][c:7]1[c:8]([O:13][CH3:14])[cH:9][cH:10][cH:11][cH:12]1)[c:15]1[c:16]([Cl:21])[cH:17][cH:18][cH:19][cH:20]1>>[OH:1][CH:2]([CH2:3][NH2:4])[CH:5]([O:6][c:7]1[c:8]([O:13][CH3:14])[cH:9][cH:10][cH:11][cH:12]1)[c:15]1[c:16]([Cl:21])[cH:17][cH:18][cH:19][cH:20]1

Participants

4

Sources & evidence

ORD record
ord-f1ae8f8b8eb845c0a439699900621753
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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