Acetic Acid → HCID 3107541, compound

HRID 676970Notes

Reaction equation

HRID 676970 reaction equation
[CH3:29][C:30]([OH:31])=[O:32].[OH2:33].[c:1]1([CH2:7][C:8](=[O:9])[NH:10][CH:11]2[CH:12]3[N:13]([CH:14]([C:19](=[O:20])[O:21][CH2:22][C:23]([Cl:24])([Cl:25])[Cl:26])[C:15]([CH3:17])([CH3:18])[S:16]3)[C:27]2=[O:28])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH2:7][C:8](=[O:9])[NH:10][CH:11]2[CH:12]3[N:13]([CH:14]([C:19](=[O:20])[O:21][CH2:22][C:23]([Cl:24])([Cl:25])[Cl:26])[C:15]([CH3:17])([CH3:18])[S:16]3=[O:31])[C:27]2=[O:28])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 962WaterHCID 12917410HCID 12917410, compound

Product 1

HCID 3107541HCID 3107541, compound

Sources & evidence

ORD record
ord-7c182219d5544814878c4bbe11a1d486
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…