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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H9N3O3
Molecular Weight 219.1968
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,2-Dihydro-2-(hydroxymethyl)-3H,8H-2a,5,8a-triazaacenaphthylene-3,8-dione, (2S)-

SMILES

OC[C@@H]1CN2C3=C(C=CC2=O)N=CC(=O)N13

InChI

InChIKey=IDQOMUQLBOXVDI-LURJTMIESA-N
InChI=1S/C10H9N3O3/c14-5-6-4-12-8(15)2-1-7-10(12)13(6)9(16)3-11-7/h1-3,6,14H,4-5H2/t6-/m0/s1

HIDE SMILES / InChI

Molecular Formula C10H9N3O3
Molecular Weight 219.1968
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 Wed Apr 02 19:53:09 GMT 2025
Edited
by admin
on Wed Apr 02 19:53:09 GMT 2025
Record UNII
74L596MSF9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(2S)-1,2-Dihydro-2-(hydroxymethyl)-3H,8H-2a,5,8a-triazaacenaphthylene-3,8-dione
Preferred Name English
1,2-Dihydro-2-(hydroxymethyl)-3H,8H-2a,5,8a-triazaacenaphthylene-3,8-dione, (2S)-
Systematic Name English
3H,8H-2a,5,8a-Triazaacenaphthylene-3,8-dione, 1,2-dihydro-2-(hydroxymethyl)-, (2S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
58001793
Created by admin on Wed Apr 02 19:53:09 GMT 2025 , Edited by admin on Wed Apr 02 19:53:09 GMT 2025
PRIMARY
CAS
1198016-28-2
Created by admin on Wed Apr 02 19:53:09 GMT 2025 , Edited by admin on Wed Apr 02 19:53:09 GMT 2025
PRIMARY
FDA UNII
74L596MSF9
Created by admin on Wed Apr 02 19:53:09 GMT 2025 , Edited by admin on Wed Apr 02 19:53:09 GMT 2025
PRIMARY