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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H17F3N2O4
Molecular Weight 406.3552
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FLOCTAFENINE, (R)-

SMILES

OC[C@@H](O)COC(=O)C1=C(NC2=C3C=CC=C(C3=NC=C2)C(F)(F)F)C=CC=C1

InChI

InChIKey=APQPGQGAWABJLN-GFCCVEGCSA-N
InChI=1S/C20H17F3N2O4/c21-20(22,23)15-6-3-5-13-17(8-9-24-18(13)15)25-16-7-2-1-4-14(16)19(28)29-11-12(27)10-26/h1-9,12,26-27H,10-11H2,(H,24,25)/t12-/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H17F3N2O4
Molecular Weight 406.3552
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:31:24 UTC 2023
Edited
by admin
on Fri Dec 15 19:31:24 UTC 2023
Record UNII
9YH7975LEF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FLOCTAFENINE, (R)-
Common Name English
BENZOIC ACID, 2-((8-(TRIFLUOROMETHYL)-4-QUINOLINYL)AMINO)-, 2,3-DIHYDROXYPROPYL ESTER, (R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
76958517
Created by admin on Fri Dec 15 19:31:24 UTC 2023 , Edited by admin on Fri Dec 15 19:31:24 UTC 2023
PRIMARY
FDA UNII
9YH7975LEF
Created by admin on Fri Dec 15 19:31:24 UTC 2023 , Edited by admin on Fri Dec 15 19:31:24 UTC 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER