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Details

Stereochemistry RACEMIC
Molecular Formula C18H26N4O2
Molecular Weight 330.4246
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AB-PINACA, (±)-

SMILES

CCCCCN1N=C(C(=O)NC(C(C)C)C(N)=O)C2=C1C=CC=C2

InChI

InChIKey=GIMHPAQOAAZSHS-UHFFFAOYSA-N
InChI=1S/C18H26N4O2/c1-4-5-8-11-22-14-10-7-6-9-13(14)16(21-22)18(24)20-15(12(2)3)17(19)23/h6-7,9-10,12,15H,4-5,8,11H2,1-3H3,(H2,19,23)(H,20,24)

HIDE SMILES / InChI

Molecular Formula C18H26N4O2
Molecular Weight 330.4246
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:26:18 GMT 2023
Edited
by admin
on Sat Dec 16 18:26:18 GMT 2023
Record UNII
3KIP69YNQK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AB-PINACA, (±)-
Common Name English
1H-INDAZOLE-3-CARBOXAMIDE, N-(1-(AMINOCARBONYL)-2-METHYLPROPYL)-1-PENTYL-
Systematic Name English
N-(1-AMINO-3-METHYL-1-OXOBUTAN-2-YL)-1-PENTYL-1H-INDAZOLE-3-CARBOXAMIDE
Systematic Name English
Classification Tree Code System Code
DEA NO. 7023
Created by admin on Sat Dec 16 18:26:18 GMT 2023 , Edited by admin on Sat Dec 16 18:26:18 GMT 2023
Code System Code Type Description
CAS
1445583-20-9
Created by admin on Sat Dec 16 18:26:18 GMT 2023 , Edited by admin on Sat Dec 16 18:26:18 GMT 2023
PRIMARY
PUBCHEM
86567422
Created by admin on Sat Dec 16 18:26:18 GMT 2023 , Edited by admin on Sat Dec 16 18:26:18 GMT 2023
PRIMARY
FDA UNII
3KIP69YNQK
Created by admin on Sat Dec 16 18:26:18 GMT 2023 , Edited by admin on Sat Dec 16 18:26:18 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY