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

Details

Stereochemistry ACHIRAL
Molecular Formula C21H19ClFN3O3
Molecular Weight 415.845
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-Chloro-1-(4-fluorophenyl)-1,4-dihydro-6-(4-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid

SMILES

CN1CCN(CC1)C2=C(Cl)C=C3N(C=C(C(O)=O)C(=O)C3=C2)C4=CC=C(F)C=C4

InChI

InChIKey=YZLGVYGDTFRLRO-UHFFFAOYSA-N
InChI=1S/C21H19ClFN3O3/c1-24-6-8-25(9-7-24)19-10-15-18(11-17(19)22)26(12-16(20(15)27)21(28)29)14-4-2-13(23)3-5-14/h2-5,10-12H,6-9H2,1H3,(H,28,29)

HIDE SMILES / InChI

Molecular Formula C21H19ClFN3O3
Molecular Weight 415.845
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 19:36:01 GMT 2023
Edited
by admin
on Sat Dec 16 19:36:01 GMT 2023
Record UNII
9TSE2Y7PCG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7-Chloro-1-(4-fluorophenyl)-1,4-dihydro-6-(4-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid
Systematic Name English
DIFLOXACIN HYDROCHLORIDE TRIHYDRATE FOR VETERINARY USE IMPURITY E [EP IMPURITY]
Common Name English
7-chloro-1-(4-fluorophenyl)-6-(4-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Systematic Name English
3-Quinolinecarboxylic acid, 7-chloro-1-(4-fluorophenyl)-1,4-dihydro-6-(4-methyl-1-piperazinyl)-4-oxo-
Common Name English
Code System Code Type Description
CAS
211236-46-3
Created by admin on Sat Dec 16 19:36:01 GMT 2023 , Edited by admin on Sat Dec 16 19:36:01 GMT 2023
PRIMARY
PUBCHEM
15318748
Created by admin on Sat Dec 16 19:36:01 GMT 2023 , Edited by admin on Sat Dec 16 19:36:01 GMT 2023
PRIMARY
FDA UNII
9TSE2Y7PCG
Created by admin on Sat Dec 16 19:36:01 GMT 2023 , Edited by admin on Sat Dec 16 19:36:01 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY