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Details

Stereochemistry ACHIRAL
Molecular Formula C26H35ClN2O4
Molecular Weight 475.02
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(2,4-Bis(tert-pentyl)phenoxy)-N-(4-chloro-3-nitrophenyl)butyramide

SMILES

CCC(C)(C)C1=CC=C(OCCCC(=O)NC2=CC(=C(Cl)C=C2)[N+]([O-])=O)C(=C1)C(C)(C)CC

InChI

InChIKey=ZUAUHOGKVXHHOK-UHFFFAOYSA-N
InChI=1S/C26H35ClN2O4/c1-7-25(3,4)18-11-14-23(20(16-18)26(5,6)8-2)33-15-9-10-24(30)28-19-12-13-21(27)22(17-19)29(31)32/h11-14,16-17H,7-10,15H2,1-6H3,(H,28,30)

HIDE SMILES / InChI

Molecular Formula C26H35ClN2O4
Molecular Weight 475.02
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 Sat Dec 16 11:56:46 GMT 2023
Edited
by admin
on Sat Dec 16 11:56:46 GMT 2023
Record UNII
447P38WEE3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(2,4-Bis(tert-pentyl)phenoxy)-N-(4-chloro-3-nitrophenyl)butyramide
Systematic Name English
4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]-N-(4-chloro-3-nitrophenyl)butanamide
Systematic Name English
4-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-(4-chloro-3-nitrophenyl)butanamide
Systematic Name English
Butanamide, 4-[2,4-bis(1,1-dimethylpropyl)phenoxy]-N-(4-chloro-3-nitrophenyl)-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
263-918-2
Created by admin on Sat Dec 16 11:56:46 GMT 2023 , Edited by admin on Sat Dec 16 11:56:46 GMT 2023
PRIMARY
PUBCHEM
113059
Created by admin on Sat Dec 16 11:56:46 GMT 2023 , Edited by admin on Sat Dec 16 11:56:46 GMT 2023
PRIMARY
CAS
63134-29-2
Created by admin on Sat Dec 16 11:56:46 GMT 2023 , Edited by admin on Sat Dec 16 11:56:46 GMT 2023
PRIMARY
EPA CompTox
DTXSID7052313
Created by admin on Sat Dec 16 11:56:46 GMT 2023 , Edited by admin on Sat Dec 16 11:56:46 GMT 2023
PRIMARY
FDA UNII
447P38WEE3
Created by admin on Sat Dec 16 11:56:46 GMT 2023 , Edited by admin on Sat Dec 16 11:56:46 GMT 2023
PRIMARY