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Details

Stereochemistry RACEMIC
Molecular Formula C11H10N2O3
Molecular Weight 218.2087
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 218.2087
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 Thu Jul 06 14:23:53 UTC 2023
Edited
by admin
on Thu Jul 06 14:23:53 UTC 2023
Record UNII
9XO29156N4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(HYDROXYMETHYLENE)-6-PHENYLPIPERAZINE-2,5-DIONE
Systematic Name English
2,5-PIPERAZINEDIONE, 3-(HYDROXYMETHYLENE)-6-PHENYL-
Systematic Name English
(E)-3-(HYDROXYMETHYLENE)-6-PHENYLPIPERAZINE-2,5-DIONE
Systematic Name English
Code System Code Type Description
CAS
142975-48-2
Created by admin on Thu Jul 06 14:23:53 UTC 2023 , Edited by admin on Thu Jul 06 14:23:53 UTC 2023
PRIMARY
FDA UNII
9XO29156N4
Created by admin on Thu Jul 06 14:23:53 UTC 2023 , Edited by admin on Thu Jul 06 14:23:53 UTC 2023
PRIMARY
PUBCHEM
86278265
Created by admin on Thu Jul 06 14:23:53 UTC 2023 , Edited by admin on Thu Jul 06 14:23:53 UTC 2023
PRIMARY
EPA CompTox
DTXSID00770953
Created by admin on Thu Jul 06 14:23:53 UTC 2023 , Edited by admin on Thu Jul 06 14:23:53 UTC 2023
PRIMARY
CAS
62673-91-0
Created by admin on Thu Jul 06 14:23:53 UTC 2023 , Edited by admin on Thu Jul 06 14:23:53 UTC 2023
ALTERNATIVE
Related Record Type Details
PARENT -> IMPURITY