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

Details

Stereochemistry RACEMIC
Molecular Formula C11H10N2O3
Molecular Weight 218.2091
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3-(HYDROXYMETHYLENE)-6-PHENYLPIPERAZINE-2,5-DIONE

SMILES

O\C=C1\NC(=O)C(NC1=O)C2=CC=CC=C2

InChI

InChIKey=WSNUQNLXONWSFX-SOFGYWHQSA-N
InChI=1S/C11H10N2O3/c14-6-8-10(15)13-9(11(16)12-8)7-4-2-1-3-5-7/h1-6,9,14H,(H,12,16)(H,13,15)/b8-6+

HIDE SMILES / InChI

Molecular Formula C11H10N2O3
Molecular Weight 218.2091
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:22:48 GMT 2025
Edited
by admin
on Mon Mar 31 22:22:48 GMT 2025
Record UNII
9XO29156N4
Record Status FAILED
Record Version
  • Download
Name Type Language
3-(HYDROXYMETHYLENE)-6-PHENYLPIPERAZINE-2,5-DIONE
Systematic Name English
(E)-3-(HYDROXYMETHYLENE)-6-PHENYLPIPERAZINE-2,5-DIONE
Preferred Name English
2,5-PIPERAZINEDIONE, 3-(HYDROXYMETHYLENE)-6-PHENYL-
Systematic Name English
Code System Code Type Description
CAS
142975-48-2
Created by admin on Mon Mar 31 22:22:48 GMT 2025 , Edited by admin on Mon Mar 31 22:22:48 GMT 2025
PRIMARY
FDA UNII
9XO29156N4
Created by admin on Mon Mar 31 22:22:48 GMT 2025 , Edited by admin on Mon Mar 31 22:22:48 GMT 2025
PRIMARY
PUBCHEM
86278265
Created by admin on Mon Mar 31 22:22:48 GMT 2025 , Edited by admin on Mon Mar 31 22:22:48 GMT 2025
PRIMARY
EPA CompTox
DTXSID00770953
Created by admin on Mon Mar 31 22:22:48 GMT 2025 , Edited by admin on Mon Mar 31 22:22:48 GMT 2025
PRIMARY
CAS
62673-91-0
Created by admin on Mon Mar 31 22:22:48 GMT 2025 , Edited by admin on Mon Mar 31 22:22:48 GMT 2025
ALTERNATIVE
Related Record Type Details
PARENT -> IMPURITY
PARENT -> IMPURITY