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Details

Stereochemistry MIXED
Molecular Formula C16H23NO3.ClH
Molecular Weight 313.82
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-SEC-BUTYL PENTYLONE HYDROCHLORIDE

SMILES

Cl.CCCC(NC(C)CC)C(=O)C1=CC2=C(OCO2)C=C1

InChI

InChIKey=YUUNTKWWQPPUNS-UHFFFAOYSA-N
InChI=1S/C16H23NO3.ClH/c1-4-6-13(17-11(3)5-2)16(18)12-7-8-14-15(9-12)20-10-19-14;/h7-9,11,13,17H,4-6,10H2,1-3H3;1H

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
1-(BENZO(D)(1,3)DIOXOL-5-YL)-2-(SEC-BUTYLAMINO)PENTAN-1-ONE HYDROCHLORIDE
Preferred Name English
N-SEC-BUTYL PENTYLONE HYDROCHLORIDE
Common Name English
VALEROPHENONE, 2-(SEC-BUTYLAMINO)-3',4'-(METHYLENEDIOXY)-, HYDROCHLORIDE
Systematic Name English
1-PENTANONE, 1-(1,3-BENZODIOXOL-5-YL)-2-((1-METHYLPROPYL)AMINO)-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
CAS
17763-05-2
Created by admin on Wed Apr 02 11:40:25 GMT 2025 , Edited by admin on Wed Apr 02 11:40:25 GMT 2025
PRIMARY
EPA CompTox
DTXSID201345661
Created by admin on Wed Apr 02 11:40:25 GMT 2025 , Edited by admin on Wed Apr 02 11:40:25 GMT 2025
PRIMARY
FDA UNII
NJE5VQ5HUQ
Created by admin on Wed Apr 02 11:40:25 GMT 2025 , Edited by admin on Wed Apr 02 11:40:25 GMT 2025
PRIMARY
PUBCHEM
155907981
Created by admin on Wed Apr 02 11:40:25 GMT 2025 , Edited by admin on Wed Apr 02 11:40:25 GMT 2025
PRIMARY
NIH
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