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Hydrochloric Acid → HCID 178450882, compound

HRID 1126154
Notes
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Reaction equation

HRID 1126154 reaction equation
[C:32](=[O:33])([OH:34])[O-:35].[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][C:6]([CH2:7][CH:8]1[N:9]([C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[CH2:10][CH2:11][c:12]2[c:13]([CH3:20])[c:14]([C:18]#[N:19])[cH:15][cH:16][c:17]21)=[O:28].[CH3:37][CH2:38][OH:39].[ClH:29].[NH2:30][OH:31].[Na+:36]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][C:6]([CH2:7][CH:8]1[N:9]([C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[CH2:10][CH2:11][c:12]2[c:13]([CH3:20])[c:14]([C:18](=[NH:19])[NH:30][OH:31])[cH:15][cH:16][c:17]21)=[O:28]
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 702EthanolHCID 769Bicarbonate IonHCID 787HydroxylamineHCID 923Sodium IonHCID 595910861,1-Dimethylethyl 1-[2-(butyloxy)-2-oxoethyl]-6-cyano-5-methyl-3,4-dihydro-2(1H)-isoquinolinecarboxylate

Product 1

HCID 178450882
HCID 178450882, compound

Sources & evidence

ORD record
ord-85d08b68fe174838a0c1ccee84399434
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes