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Details

Stereochemistry ACHIRAL
Molecular Formula C24H37N3O2
Molecular Weight 399.5695
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PD-78799

SMILES

CCOC1=CC(=CC=C1)N2CCN(CCCCNC3=CC(=O)CC(C)(C)C3)CC2

InChI

InChIKey=CBLMDPUGHGWHDY-UHFFFAOYSA-N
InChI=1S/C24H37N3O2/c1-4-29-23-9-7-8-21(17-23)27-14-12-26(13-15-27)11-6-5-10-25-20-16-22(28)19-24(2,3)18-20/h7-9,16-17,25H,4-6,10-15,18-19H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C24H37N3O2
Molecular Weight 399.5695
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 Mon Mar 31 17:50:19 GMT 2025
Edited
by admin
on Mon Mar 31 17:50:19 GMT 2025
Record UNII
FNV8YY3C0G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PD-78799
Code English
2-CYCLOHEXEN-1-ONE, 3-((4-(4-(3-ETHOXYPHENYL)-1-PIPERAZINYL)BUTYL)AMINO)-5,5-DIMETHYL-
Preferred Name English
3-((4-(4-(3-ETHOXYPHENYL)-1-PIPERAZINYL)BUTYL)AMINO)-5,5-DIMETHYL-2-CYCLOHEXEN-1-ONE
Systematic Name English
Code System Code Type Description
PUBCHEM
3028121
Created by admin on Mon Mar 31 17:50:19 GMT 2025 , Edited by admin on Mon Mar 31 17:50:19 GMT 2025
PRIMARY
CAS
90931-09-2
Created by admin on Mon Mar 31 17:50:19 GMT 2025 , Edited by admin on Mon Mar 31 17:50:19 GMT 2025
PRIMARY
EPA CompTox
DTXSID001129093
Created by admin on Mon Mar 31 17:50:19 GMT 2025 , Edited by admin on Mon Mar 31 17:50:19 GMT 2025
PRIMARY
FDA UNII
FNV8YY3C0G
Created by admin on Mon Mar 31 17:50:19 GMT 2025 , Edited by admin on Mon Mar 31 17:50:19 GMT 2025
PRIMARY