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Details

Stereochemistry ACHIRAL
Molecular Formula C15H18N2O3
Molecular Weight 274.315
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-((4-HYDROXYCYCLOHEXYL)METHYL)-1H-INDAZOLE-3-CARBOXYLIC ACID

SMILES

OC1CCC(CN2N=C(C(O)=O)C3=C2C=CC=C3)CC1

InChI

InChIKey=XMHBGLQLPWENIV-UHFFFAOYSA-N
InChI=1S/C15H18N2O3/c18-11-7-5-10(6-8-11)9-17-13-4-2-1-3-12(13)14(16-17)15(19)20/h1-4,10-11,18H,5-9H2,(H,19,20)

HIDE SMILES / InChI

Molecular Formula C15H18N2O3
Molecular Weight 274.315
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 18:30:45 GMT 2023
Edited
by admin
on Sat Dec 16 18:30:45 GMT 2023
Record UNII
HEV54ZU2VP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-((4-HYDROXYCYCLOHEXYL)METHYL)-1H-INDAZOLE-3-CARBOXYLIC ACID
Systematic Name English
1H-INDAZOLE-3-CARBOXYLIC ACID, 1-((4-HYDROXYCYCLOHEXYL)METHYL)-
Systematic Name English
AB-CHMINACA METABOLITE M5A
Common Name English
Code System Code Type Description
CAYMAN
16394
Created by admin on Sat Dec 16 18:30:45 GMT 2023 , Edited by admin on Sat Dec 16 18:30:45 GMT 2023
PRIMARY
FDA UNII
HEV54ZU2VP
Created by admin on Sat Dec 16 18:30:45 GMT 2023 , Edited by admin on Sat Dec 16 18:30:45 GMT 2023
PRIMARY
CAS
2207957-90-0
Created by admin on Sat Dec 16 18:30:45 GMT 2023 , Edited by admin on Sat Dec 16 18:30:45 GMT 2023
PRIMARY
PUBCHEM
125181435
Created by admin on Sat Dec 16 18:30:45 GMT 2023 , Edited by admin on Sat Dec 16 18:30:45 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE