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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H9N3O2
Molecular Weight 239.2295
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4,5-DIHYDRO-1H-PYRAZOLO(4',3':3,4)PYRIDO(2,1-A)ISOINDOLE-1,7(2H)-DIONE

SMILES

O=C1NN=C2CCN3C(=O)C4=C(C=CC=C4)C3=C12

InChI

InChIKey=HAVZPSFUQICONT-UHFFFAOYSA-N
InChI=1S/C13H9N3O2/c17-12-10-9(14-15-12)5-6-16-11(10)7-3-1-2-4-8(7)13(16)18/h1-4H,5-6H2,(H,15,17)

HIDE SMILES / InChI

Molecular Formula C13H9N3O2
Molecular Weight 239.2295
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 12:48:43 GMT 2023
Edited
by admin
on Sat Dec 16 12:48:43 GMT 2023
Record UNII
JKE3T5ATM7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4,5-DIHYDRO-1H-PYRAZOLO(4',3':3,4)PYRIDO(2,1-A)ISOINDOLE-1,7(2H)-DIONE
Systematic Name English
1H-PYRAZOLO(4',3':3,4)PYRIDO(2,1-A)ISOINDOLE-1,7(2H)-DIONE, 4,5-DIHYDRO-
Systematic Name English
NSC-335048
Code English
Code System Code Type Description
FDA UNII
JKE3T5ATM7
Created by admin on Sat Dec 16 12:48:43 GMT 2023 , Edited by admin on Sat Dec 16 12:48:43 GMT 2023
PRIMARY
CAS
66799-57-3
Created by admin on Sat Dec 16 12:48:43 GMT 2023 , Edited by admin on Sat Dec 16 12:48:43 GMT 2023
PRIMARY
NSC
335048
Created by admin on Sat Dec 16 12:48:43 GMT 2023 , Edited by admin on Sat Dec 16 12:48:43 GMT 2023
PRIMARY
PUBCHEM
5384461
Created by admin on Sat Dec 16 12:48:43 GMT 2023 , Edited by admin on Sat Dec 16 12:48:43 GMT 2023
PRIMARY
EPA CompTox
DTXSID90216916
Created by admin on Sat Dec 16 12:48:43 GMT 2023 , Edited by admin on Sat Dec 16 12:48:43 GMT 2023
PRIMARY