Hydrochloric Acid → HCID 145857553, compound

HRID 1225311Notes

Reaction equation

HRID 1225311 reaction equation
[C:1]([CH2:2][CH2:3][O:5][C:6](=[O:7])[C:8]1=[C:9]([CH3:46])[N:10]([CH3:45])[C:11]([O:39][CH2:40][CH2:41][N:42]=[N+:43]=[N-:44])=[C:12]([C:21]([NH:22][CH2:23][CH2:24][CH:25]([c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)=[O:38])[CH:13]1[c:14]1[cH:15][c:16]([Cl:20])[cH:17][cH:18][cH:19]1)#[N:4].[CH3:51][OH:52].[ClH:49].[Na+:48].[OH-:47].[OH2:50]>>[O:5]=[C:6]([OH:7])[C:8]1=[C:9]([CH3:46])[N:10]([CH3:45])[C:11]([O:39][CH2:40][CH2:41][N:42]=[N+:43]=[N-:44])=[C:12]([C:21]([NH:22][CH2:23][CH2:24][CH:25]([c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)=[O:38])[CH:13]1[c:14]1[cH:15][c:16]([Cl:20])[cH:17][cH:18][cH:19]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 141593444HCID 141593444, compound

Product 1

HCID 145857553HCID 145857553, compound

Sources & evidence

ORD record
ord-b87e3f6134ee46b98403551e6560580d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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