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Details

Stereochemistry RACEMIC
Molecular Formula C17H18F2N4O3
Molecular Weight 364.3466
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PD-124816

SMILES

NC1CCN(C1)C2=C(F)C3=C(C(=O)C(=CN3C4CC4)C(O)=O)C(N)=C2F

InChI

InChIKey=GMCYYXZTVSSTQW-UHFFFAOYSA-N
InChI=1S/C17H18F2N4O3/c18-11-13(21)10-14(12(19)15(11)22-4-3-7(20)5-22)23(8-1-2-8)6-9(16(10)24)17(25)26/h6-8H,1-5,20-21H2,(H,25,26)

HIDE SMILES / InChI

Molecular Formula C17H18F2N4O3
Molecular Weight 364.3466
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:58:16 GMT 2025
Edited
by admin
on Mon Mar 31 21:58:16 GMT 2025
Record UNII
4FJJ4S79YV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-QUINOLINECARBOXYLIC ACID, 5-AMINO-7-(3-AMINO-1-PYRROLIDINYL)-1-CYCLOPROPYL-6,8-DIFLUORO-1,4-DIHYDRO-4-OXO-
Preferred Name English
PD-124816
Common Name English
5-AMINO-7-(3-AMINO-1-PYRROLIDINYL)-1-CYCLOPROPYL-6,8-DIFLUORO-1,4-DIHYDRO-4-OXO-3-QUINOLINECARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID50920860
Created by admin on Mon Mar 31 21:58:16 GMT 2025 , Edited by admin on Mon Mar 31 21:58:16 GMT 2025
PRIMARY
FDA UNII
4FJJ4S79YV
Created by admin on Mon Mar 31 21:58:16 GMT 2025 , Edited by admin on Mon Mar 31 21:58:16 GMT 2025
PRIMARY
CAS
112654-98-5
Created by admin on Mon Mar 31 21:58:16 GMT 2025 , Edited by admin on Mon Mar 31 21:58:16 GMT 2025
PRIMARY
PUBCHEM
130713
Created by admin on Mon Mar 31 21:58:16 GMT 2025 , Edited by admin on Mon Mar 31 21:58:16 GMT 2025
PRIMARY