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Details

Stereochemistry ACHIRAL
Molecular Formula C37H46N2O4
Molecular Weight 582.7721
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(4-Aminophenoxy)-N-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-2-naphthalenecarboxamide

SMILES

CCC(C)(C)C1=CC=C(OCCCCNC(=O)C2=CC(OC3=CC=C(N)C=C3)=C4C=CC=CC4=C2O)C(=C1)C(C)(C)CC

InChI

InChIKey=IRSKGCDDLMCVBY-UHFFFAOYSA-N
InChI=1S/C37H46N2O4/c1-7-36(3,4)25-15-20-32(31(23-25)37(5,6)8-2)42-22-12-11-21-39-35(41)30-24-33(43-27-18-16-26(38)17-19-27)28-13-9-10-14-29(28)34(30)40/h9-10,13-20,23-24,40H,7-8,11-12,21-22,38H2,1-6H3,(H,39,41)

HIDE SMILES / InChI

Molecular Formula C37H46N2O4
Molecular Weight 582.7721
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 Tue Apr 01 18:49:50 GMT 2025
Edited
by admin
on Tue Apr 01 18:49:50 GMT 2025
Record UNII
KSN35MF34F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(4-Aminophenoxy)-N-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-2-naphthalenecarboxamide
Systematic Name English
2-Naphthalenecarboxamide, 4-(4-aminophenoxy)-N-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-
Preferred Name English
Code System Code Type Description
CAS
63149-27-9
Created by admin on Tue Apr 01 18:49:50 GMT 2025 , Edited by admin on Tue Apr 01 18:49:50 GMT 2025
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PUBCHEM
113094
Created by admin on Tue Apr 01 18:49:50 GMT 2025 , Edited by admin on Tue Apr 01 18:49:50 GMT 2025
PRIMARY
ECHA (EC/EINECS)
263-964-3
Created by admin on Tue Apr 01 18:49:50 GMT 2025 , Edited by admin on Tue Apr 01 18:49:50 GMT 2025
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FDA UNII
KSN35MF34F
Created by admin on Tue Apr 01 18:49:50 GMT 2025 , Edited by admin on Tue Apr 01 18:49:50 GMT 2025
PRIMARY
EPA CompTox
DTXSID1069740
Created by admin on Tue Apr 01 18:49:50 GMT 2025 , Edited by admin on Tue Apr 01 18:49:50 GMT 2025
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