Ethanol → HCID 59618804, compound

HRID 2142830Notes

Reaction equation

HRID 2142830 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([S:11](=[O:12])(=[O:13])[N:14]2[CH2:15][c:16]3[c:17]([n:27][c:28]([C:31]([F:32])([F:33])[F:34])[cH:29][cH:30]3)[NH:18][c:19]3[c:20]2[cH:21][c:22]([CH:25]=[O:26])[cH:23][cH:24]3)[cH:9][cH:10]1.[CH2:35]1[CH2:36][O:37][CH2:38][CH2:39][NH:40]1.[CH3:41][CH2:42][OH:43].[Na+:48].[O-:44][C:45]([OH:46])=[O:47]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([S:11](=[O:12])(=[O:13])[N:14]2[CH2:15][c:16]3[c:17]([n:27][c:28]([C:31]([F:32])([F:33])[F:34])[cH:29][cH:30]3)[NH:18][c:19]3[c:20]2[cH:21][c:22]([CH2:25][N:40]2[CH2:35][CH2:36][O:37][CH2:38][CH2:39]2)[cH:23][cH:24]3)[cH:9][cH:10]1

Participants

6

Reactant 5

HCID 702EthanolHCID 769Bicarbonate IonHCID 923Sodium ionHCID 8083MorpholineHCID 86649042HCID 86649042, compound

Product 1

HCID 59618804HCID 59618804, compound

Sources & evidence

ORD record
ord-ce7c3f1509b543878207aa37c45eb8aa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…