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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H24N2O4.ClH
Molecular Weight 344.834
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIACETOLOL HYDROCHLORIDE, (S)-

SMILES

Cl.CC(C)NC[C@H](O)COC1=C(C=C(NC(C)=O)C=C1)C(C)=O

InChI

InChIKey=RRLYGXRMVLYFNX-UQKRIMTDSA-N
InChI=1S/C16H24N2O4.ClH/c1-10(2)17-8-14(21)9-22-16-6-5-13(18-12(4)20)7-15(16)11(3)19;/h5-7,10,14,17,21H,8-9H2,1-4H3,(H,18,20);1H/t14-;/m0./s1

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C16H24N2O4
Molecular Weight 308.3728
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sun Dec 18 05:08:49 UTC 2022
Edited
by admin
on Sun Dec 18 05:08:49 UTC 2022
Record UNII
6CPZ4XTB9K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIACETOLOL HYDROCHLORIDE, (S)-
Common Name English
ACETAMIDE, N-(3-ACETYL-4-(2-HYDROXY-3-((1-METHYLETHYL)AMINO)PROPOXY)PHENYL)-, HYDROCHLORIDE (1:1), (S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
76972730
Created by admin on Sun Dec 18 05:08:49 UTC 2022 , Edited by admin on Sun Dec 18 05:08:49 UTC 2022
PRIMARY
FDA UNII
6CPZ4XTB9K
Created by admin on Sun Dec 18 05:08:49 UTC 2022 , Edited by admin on Sun Dec 18 05:08:49 UTC 2022
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER