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Details

Stereochemistry ACHIRAL
Molecular Formula C16H8BrClFNO3
Molecular Weight 396.595
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of J-78

SMILES

OC1=CC=CC2=C1C(=O)C(Cl)=C(NC3=CC=C(F)C=C3Br)C2=O

InChI

InChIKey=YQEBWKKNBNHIGE-UHFFFAOYSA-N
InChI=1S/C16H8BrClFNO3/c17-9-6-7(19)4-5-10(9)20-14-13(18)16(23)12-8(15(14)22)2-1-3-11(12)21/h1-6,20-21H

HIDE SMILES / InChI

Molecular Formula C16H8BrClFNO3
Molecular Weight 396.595
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 09:48:15 GMT 2023
Edited
by admin
on Sat Dec 16 09:48:15 GMT 2023
Record UNII
154650W0UB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
J-78
Common Name English
1,4-NAPHTHALENEDIONE, 2-((2-BROMO-4-FLUOROPHENYL)AMINO)-3-CHLORO-5-HYDROXY-
Systematic Name English
Code System Code Type Description
CAS
701980-31-6
Created by admin on Sat Dec 16 09:48:15 GMT 2023 , Edited by admin on Sat Dec 16 09:48:15 GMT 2023
PRIMARY
FDA UNII
154650W0UB
Created by admin on Sat Dec 16 09:48:15 GMT 2023 , Edited by admin on Sat Dec 16 09:48:15 GMT 2023
PRIMARY
PUBCHEM
10408464
Created by admin on Sat Dec 16 09:48:15 GMT 2023 , Edited by admin on Sat Dec 16 09:48:15 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY