U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C13H9ClFNO3
Molecular Weight 281.667
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of FERB-033

SMILES

O\N=C\C1=C(O)C(Cl)=C(C=C1)C2=CC(F)=C(O)C=C2

InChI

InChIKey=LRRMQNGSYOUANY-OMCISZLKSA-N
InChI=1S/C13H9ClFNO3/c14-12-9(3-1-8(6-16-19)13(12)18)7-2-4-11(17)10(15)5-7/h1-6,17-19H/b16-6+

HIDE SMILES / InChI

Molecular Formula C13H9ClFNO3
Molecular Weight 281.667
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:31:22 GMT 2023
Edited
by admin
on Sat Dec 16 15:31:22 GMT 2023
Record UNII
9FUT9FH3EX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FERB-033
Code English
(1,1'-BIPHENYL)-4-CARBOXALDEHYDE, 2-CHLORO-3'-FLUORO-3,4'-DIHYDROXY-, OXIME, (C(E))-
Systematic Name English
Code System Code Type Description
PUBCHEM
135931707
Created by admin on Sat Dec 16 15:31:22 GMT 2023 , Edited by admin on Sat Dec 16 15:31:22 GMT 2023
PRIMARY
WIKIPEDIA
FERb 033
Created by admin on Sat Dec 16 15:31:22 GMT 2023 , Edited by admin on Sat Dec 16 15:31:22 GMT 2023
PRIMARY
FDA UNII
9FUT9FH3EX
Created by admin on Sat Dec 16 15:31:22 GMT 2023 , Edited by admin on Sat Dec 16 15:31:22 GMT 2023
PRIMARY
CAS
1528754-10-0
Created by admin on Sat Dec 16 15:31:22 GMT 2023 , Edited by admin on Sat Dec 16 15:31:22 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
EPA CompTox
DTXSID401045277
Created by admin on Sat Dec 16 15:31:22 GMT 2023 , Edited by admin on Sat Dec 16 15:31:22 GMT 2023
PRIMARY
CAS
1111084-78-6
Created by admin on Sat Dec 16 15:31:22 GMT 2023 , Edited by admin on Sat Dec 16 15:31:22 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY