U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C14H20N2O3
Molecular Weight 264.3202
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(1-CYCLOHEXEN-1-YL)-5,5-DIETHYLBARBITURIC ACID

SMILES

CCC1(CC)C(=O)NC(=O)N(C1=O)C2=CCCCC2

InChI

InChIKey=JFISKEILZAUDSN-UHFFFAOYSA-N
InChI=1S/C14H20N2O3/c1-3-14(4-2)11(17)15-13(19)16(12(14)18)10-8-6-5-7-9-10/h8H,3-7,9H2,1-2H3,(H,15,17,19)

HIDE SMILES / InChI

Molecular Formula C14H20N2O3
Molecular Weight 264.3202
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:47:20 GMT 2023
Edited
by admin
on Sat Dec 16 11:47:20 GMT 2023
Record UNII
F8V8N7S6HZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(1-CYCLOHEXEN-1-YL)-5,5-DIETHYLBARBITURIC ACID
Systematic Name English
1-(1-CYCLOHEXEN-1-YL)-5,5-DIETHYL-2,4,6(1H,3H,5H)-PYRIMIDINETRIONE
Systematic Name English
2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, 1-(1-CYCLOHEXEN-1-YL)-5,5-DIETHYL-
Systematic Name English
Code System Code Type Description
CAS
94022-59-0
Created by admin on Sat Dec 16 11:47:20 GMT 2023 , Edited by admin on Sat Dec 16 11:47:20 GMT 2023
PRIMARY
ECHA (EC/EINECS)
301-557-5
Created by admin on Sat Dec 16 11:47:20 GMT 2023 , Edited by admin on Sat Dec 16 11:47:20 GMT 2023
PRIMARY
PUBCHEM
3023317
Created by admin on Sat Dec 16 11:47:20 GMT 2023 , Edited by admin on Sat Dec 16 11:47:20 GMT 2023
PRIMARY
EPA CompTox
DTXSID70240279
Created by admin on Sat Dec 16 11:47:20 GMT 2023 , Edited by admin on Sat Dec 16 11:47:20 GMT 2023
PRIMARY
FDA UNII
F8V8N7S6HZ
Created by admin on Sat Dec 16 11:47:20 GMT 2023 , Edited by admin on Sat Dec 16 11:47:20 GMT 2023
PRIMARY