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

Details

Stereochemistry RACEMIC
Molecular Formula C18H15ClN2O3
Molecular Weight 342.776
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL CLORAZEPATE

SMILES

CCOC(=O)C1N=C(C2=CC=CC=C2)C3=CC(Cl)=CC=C3NC1=O

InChI

InChIKey=DTKOQJNQMOCKQU-UHFFFAOYSA-N
InChI=1S/C18H15ClN2O3/c1-2-24-18(23)16-17(22)20-14-9-8-12(19)10-13(14)15(21-16)11-6-4-3-5-7-11/h3-10,16H,2H2,1H3,(H,20,22)

HIDE SMILES / InChI

Molecular Formula C18H15ClN2O3
Molecular Weight 342.776
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 Sat Dec 16 18:31:01 GMT 2023
Edited
by admin
on Sat Dec 16 18:31:01 GMT 2023
Record UNII
KC3D4ENU6H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETHYL CLORAZEPATE
Common Name English
1H-1,4-BENZODIAZEPINE-3-CARBOXYLIC ACID, 7-CHLORO-2,3-DIHYDRO-2-OXO-5-PHENYL-, ETHYL ESTER
Systematic Name English
CLORAZEPIC ACID ETHYL ESTER
Common Name English
ETHYL 7-CHLORO-2-OXO-5-PHENYL-2,3-DIHYDRO-1H-BENZO(E)(1,4)DIAZEPINE-3-CARBOXYLATE
Systematic Name English
DIPOTASSIUM CLORAZEPATE IMPURITY C [EP IMPURITY]
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID70971435
Created by admin on Sat Dec 16 18:31:01 GMT 2023 , Edited by admin on Sat Dec 16 18:31:01 GMT 2023
PRIMARY
PUBCHEM
110682
Created by admin on Sat Dec 16 18:31:01 GMT 2023 , Edited by admin on Sat Dec 16 18:31:01 GMT 2023
PRIMARY
FDA UNII
KC3D4ENU6H
Created by admin on Sat Dec 16 18:31:01 GMT 2023 , Edited by admin on Sat Dec 16 18:31:01 GMT 2023
PRIMARY
CAS
5606-55-3
Created by admin on Sat Dec 16 18:31:01 GMT 2023 , Edited by admin on Sat Dec 16 18:31:01 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP