Ethanol → HCID 86675991, compound

HRID 685742Notes

Reaction equation

HRID 685742 reaction equation
[CH2:1]([CH3:2])[c:3]1[c:4]([NH:21][C:22]([c:23]2[cH:24][c:25]([N+:34]([O-:35])=[O:36])[c:26](-[n:29]3[n:30][cH:31][n:32][cH:33]3)[cH:27][cH:28]2)=[O:37])[c:5]([CH2:19][CH3:20])[cH:6][c:7]([C:9]([C:10]([F:11])([F:12])[F:13])([C:14]([F:15])([F:16])[F:17])[F:18])[cH:8]1.[CH3:40][CH2:41][OH:42].[H:38][H:39]>>[CH2:1]([CH3:2])[c:3]1[c:4]([NH:21][C:22]([c:23]2[cH:24][c:25]([NH2:34])[c:26](-[n:29]3[n:30][cH:31][n:32][cH:33]3)[cH:27][cH:28]2)=[O:37])[c:5]([CH2:19][CH3:20])[cH:6][c:7]([C:9]([C:10]([F:11])([F:12])[F:13])([C:14]([F:15])([F:16])[F:17])[F:18])[cH:8]1

Participants

4

Reactant 3

HCID 702EthanolHCID 86675992HCID 86675992, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 86675991HCID 86675991, compound

Sources & evidence

ORD record
ord-2db85ba476fd47dcaa08450f58dcc1f1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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