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Details

Stereochemistry ACHIRAL
Molecular Formula C19H13ClFN3O2
Molecular Weight 369.777
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8-CHLORO-6-(O-FLUOROPHENYL)-1-METHYL-4H-IMIDAZO(1,5-A)(1,4)BENZODIAZEPINE-3-CARBOXYLIC ACID

SMILES

CC1=NC(C(O)=O)=C2CN=C(C3=CC=CC=C3F)C4=CC(Cl)=CC=C4N12

InChI

InChIKey=WZNYKINYEPCGAZ-UHFFFAOYSA-N
InChI=1S/C19H13ClFN3O2/c1-10-23-18(19(25)26)16-9-22-17(12-4-2-3-5-14(12)21)13-8-11(20)6-7-15(13)24(10)16/h2-8H,9H2,1H3,(H,25,26)

HIDE SMILES / InChI

Molecular Formula C19H13ClFN3O2
Molecular Weight 369.777
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 Tue Apr 01 17:48:21 GMT 2025
Edited
by admin
on Tue Apr 01 17:48:21 GMT 2025
Record UNII
P5URY5OSB9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
8-CHLORO-6-(O-FLUOROPHENYL)-1-METHYL-4H-IMIDAZO(1,5-A)(1,4)BENZODIAZEPINE-3-CARBOXYLIC ACID
Systematic Name English
MIDAZOLAM IMPURITY C [EP IMPURITY]
Preferred Name English
4H-IMIDAZO(1,5-A)(1,4)BENZODIAZEPINE-3-CARBOXYLIC ACID, 8-CHLORO-6-(2-FLUOROPHENYL)-1-METHYL-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
261-777-1
Created by admin on Tue Apr 01 17:48:21 GMT 2025 , Edited by admin on Tue Apr 01 17:48:21 GMT 2025
PRIMARY
EPA CompTox
DTXSID90208174
Created by admin on Tue Apr 01 17:48:21 GMT 2025 , Edited by admin on Tue Apr 01 17:48:21 GMT 2025
PRIMARY
CAS
59468-44-9
Created by admin on Tue Apr 01 17:48:21 GMT 2025 , Edited by admin on Tue Apr 01 17:48:21 GMT 2025
PRIMARY
PUBCHEM
101062
Created by admin on Tue Apr 01 17:48:21 GMT 2025 , Edited by admin on Tue Apr 01 17:48:21 GMT 2025
PRIMARY
FDA UNII
P5URY5OSB9
Created by admin on Tue Apr 01 17:48:21 GMT 2025 , Edited by admin on Tue Apr 01 17:48:21 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP