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Details

Stereochemistry RACEMIC
Molecular Formula C16H23NO3.ClH
Molecular Weight 313.82
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N-DIETHYLPENTYLONE HYDROCHLORIDE

SMILES

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

InChI

InChIKey=QIMFWZHGOUCRRT-UHFFFAOYSA-N
InChI=1S/C16H23NO3.ClH/c1-4-7-13(17(5-2)6-3)16(18)12-8-9-14-15(10-12)20-11-19-14;/h8-10,13H,4-7,11H2,1-3H3;1H

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
N,N-DIETHYLPENTYLONE HYDROCHLORIDE
Systematic Name English
1-(BENZO(D)(1,3)DIOXOL-5-YL)-2-(DIETHYLAMINO)PENTAN-1-ONE HYDROCHLORIDE
Preferred Name English
VALEROPHENONE, 2-(DIETHYLAMINO)-3',4'-(METHYLENEDIOXY)-, HYDROCHLORIDE
Systematic Name English
1-PENTANONE, 1-(1,3-BENZODIOXOL-5-YL)-2-(DIETHYLAMINO)-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
3FN7K53F4N
Created by admin on Wed Apr 02 11:46:46 GMT 2025 , Edited by admin on Wed Apr 02 11:46:46 GMT 2025
PRIMARY
PUBCHEM
132989249
Created by admin on Wed Apr 02 11:46:46 GMT 2025 , Edited by admin on Wed Apr 02 11:46:46 GMT 2025
PRIMARY
CAS
17763-15-4
Created by admin on Wed Apr 02 11:46:46 GMT 2025 , Edited by admin on Wed Apr 02 11:46:46 GMT 2025
PRIMARY
EPA CompTox
DTXSID701342050
Created by admin on Wed Apr 02 11:46:46 GMT 2025 , Edited by admin on Wed Apr 02 11:46:46 GMT 2025
PRIMARY
NIH
NCATS
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