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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H7N3O2
Molecular Weight 189.1708
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(4-NITROPHENYL)-1H-PYRAZOLE

SMILES

[O-][N+](=O)C1=CC=C(C=C1)C2=NNC=C2

InChI

InChIKey=IPIYADCDDIUVPS-UHFFFAOYSA-N
InChI=1S/C9H7N3O2/c13-12(14)8-3-1-7(2-4-8)9-5-6-10-11-9/h1-6H,(H,10,11)

HIDE SMILES / InChI

Molecular Formula C9H7N3O2
Molecular Weight 189.1708
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 11:35:26 GMT 2023
Edited
by admin
on Sat Dec 16 11:35:26 GMT 2023
Record UNII
K0B6P40GV5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(4-NITROPHENYL)-1H-PYRAZOLE
Systematic Name English
3-(4-NITROPHENYL)PYRAZOLE
Systematic Name English
1H-PYRAZOLE, 3-(4-NITROPHENYL)-
Systematic Name English
Code System Code Type Description
DRUG BANK
DB08695
Created by admin on Sat Dec 16 11:35:26 GMT 2023 , Edited by admin on Sat Dec 16 11:35:26 GMT 2023
PRIMARY
EPA CompTox
DTXSID10371814
Created by admin on Sat Dec 16 11:35:26 GMT 2023 , Edited by admin on Sat Dec 16 11:35:26 GMT 2023
PRIMARY
CAS
20583-31-7
Created by admin on Sat Dec 16 11:35:26 GMT 2023 , Edited by admin on Sat Dec 16 11:35:26 GMT 2023
PRIMARY
PUBCHEM
2737071
Created by admin on Sat Dec 16 11:35:26 GMT 2023 , Edited by admin on Sat Dec 16 11:35:26 GMT 2023
PRIMARY
FDA UNII
K0B6P40GV5
Created by admin on Sat Dec 16 11:35:26 GMT 2023 , Edited by admin on Sat Dec 16 11:35:26 GMT 2023
PRIMARY