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Details

Stereochemistry ACHIRAL
Molecular Formula C26H22FNO3
Molecular Weight 415.4562
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(3?-Butoxy[1,1?-biphenyl]-4-yl)-6-fluoro-4-quinolinecarboxylic acid

SMILES

CCCCOC1=CC=CC(=C1)C2=CC=C(C=C2)C3=CC(C(O)=O)=C4C=C(F)C=CC4=N3

InChI

InChIKey=IVBVOODSLSKWSO-UHFFFAOYSA-N
InChI=1S/C26H22FNO3/c1-2-3-13-31-21-6-4-5-19(14-21)17-7-9-18(10-8-17)25-16-23(26(29)30)22-15-20(27)11-12-24(22)28-25/h4-12,14-16H,2-3,13H2,1H3,(H,29,30)

HIDE SMILES / InChI

Molecular Formula C26H22FNO3
Molecular Weight 415.4562
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 Wed Apr 02 21:00:23 GMT 2025
Edited
by admin
on Wed Apr 02 21:00:23 GMT 2025
Record UNII
B8N8U2C2VJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(3?-Butoxy[1,1?-biphenyl]-4-yl)-6-fluoro-4-quinolinecarboxylic acid
Systematic Name English
4-Quinolinecarboxylic acid, 2-(3?-butoxy[1,1?-biphenyl]-4-yl)-6-fluoro-
Preferred Name English
Code System Code Type Description
CAS
2659233-16-4
Created by admin on Wed Apr 02 21:00:23 GMT 2025 , Edited by admin on Wed Apr 02 21:00:23 GMT 2025
PRIMARY
FDA UNII
B8N8U2C2VJ
Created by admin on Wed Apr 02 21:00:23 GMT 2025 , Edited by admin on Wed Apr 02 21:00:23 GMT 2025
PRIMARY
PUBCHEM
156535961
Created by admin on Wed Apr 02 21:00:23 GMT 2025 , Edited by admin on Wed Apr 02 21:00:23 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY