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Details

Stereochemistry RACEMIC
Molecular Formula C16H23NO3
Molecular Weight 277.3587
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N-DIETHYLPENTYLONE

SMILES

CCCC(N(CC)CC)C(=O)C1=CC=C2OCOC2=C1

InChI

InChIKey=CUPSLSIMIHCVIA-UHFFFAOYSA-N
InChI=1S/C16H23NO3/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

HIDE SMILES / InChI

Molecular Formula C16H23NO3
Molecular Weight 277.3587
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 18:11:12 GMT 2023
Edited
by admin
on Sat Dec 16 18:11:12 GMT 2023
Record UNII
X9AJ3K79RT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N,N-DIETHYLPENTYLONE
Systematic Name English
1-PENTANONE, 1-(1,3-BENZODIOXOL-5-YL)-2-(DIETHYLAMINO)-
Systematic Name English
VALEROPHENONE, 2-(DIETHYLAMINO)-3',4'-(METHYLENEDIOXY)-
Systematic Name English
1-(1,3-BENZODIOXOL-5-YL)-2-(DIETHYLAMINO)-1-PENTANONE
Systematic Name English
1-(BENZO(D)(1,3)DIOXOL-5-YL)-2-(DIETHYLAMINO)PENTAN-1-ONE
Systematic Name English
Code System Code Type Description
CAS
801171-27-7
Created by admin on Sat Dec 16 18:11:12 GMT 2023 , Edited by admin on Sat Dec 16 18:11:12 GMT 2023
PRIMARY
PUBCHEM
132989250
Created by admin on Sat Dec 16 18:11:12 GMT 2023 , Edited by admin on Sat Dec 16 18:11:12 GMT 2023
PRIMARY
FDA UNII
X9AJ3K79RT
Created by admin on Sat Dec 16 18:11:12 GMT 2023 , Edited by admin on Sat Dec 16 18:11:12 GMT 2023
PRIMARY
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