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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H8N2O2
Molecular Weight 176.172
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-CARBOXY-1-METHYLINDAZOLE

SMILES

CN1N=C(C(O)=O)C2=CC=CC=C12

InChI

InChIKey=OVVDFORZEGKEJM-UHFFFAOYSA-N
InChI=1S/C9H8N2O2/c1-11-7-5-3-2-4-6(7)8(10-11)9(12)13/h2-5H,1H3,(H,12,13)

HIDE SMILES / InChI

Molecular Formula C9H8N2O2
Molecular Weight 176.172
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 11:19:07 GMT 2023
Edited
by admin
on Sat Dec 16 11:19:07 GMT 2023
Record UNII
F9P5J2E2BU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-CARBOXY-1-METHYLINDAZOLE
Common Name English
GRANISETRON RELATED COMPOUND D [USP-RS]
Common Name English
1-METHYL-1H-INDAZOLE-3-CARBOXYLIC ACID
Common Name English
1H-INDAZOLE-3-CARBOXYLIC ACID, 1-METHYL-
Systematic Name English
GRANISETRON HYDROCHLORIDE IMPURITY D [EP IMPURITY]
Common Name English
Code System Code Type Description
CAS
50890-83-0
Created by admin on Sat Dec 16 11:19:07 GMT 2023 , Edited by admin on Sat Dec 16 11:19:07 GMT 2023
PRIMARY
FDA UNII
F9P5J2E2BU
Created by admin on Sat Dec 16 11:19:07 GMT 2023 , Edited by admin on Sat Dec 16 11:19:07 GMT 2023
PRIMARY
EPA CompTox
DTXSID10351050
Created by admin on Sat Dec 16 11:19:07 GMT 2023 , Edited by admin on Sat Dec 16 11:19:07 GMT 2023
PRIMARY
RS_ITEM_NUM
1298140
Created by admin on Sat Dec 16 11:19:07 GMT 2023 , Edited by admin on Sat Dec 16 11:19:07 GMT 2023
PRIMARY
PUBCHEM
689105
Created by admin on Sat Dec 16 11:19:07 GMT 2023 , Edited by admin on Sat Dec 16 11:19:07 GMT 2023
PRIMARY
Related Record Type Details
INNOVATOR->PARENT
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP