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

Details

Stereochemistry ABSOLUTE
Molecular Formula C17H17ClN6O4
Molecular Weight 404.808
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ZOPICLONE N-OXIDE, (-)-

SMILES

C[N+]1([O-])CCN(CC1)C(=O)O[C@H]2N(C(=O)C3=C2N=CC=N3)C4=CC=C(Cl)C=N4

InChI

InChIKey=IPTIKKTXLHVRKN-MRXNPFEDSA-N
InChI=1S/C17H17ClN6O4/c1-24(27)8-6-22(7-9-24)17(26)28-16-14-13(19-4-5-20-14)15(25)23(16)12-3-2-11(18)10-21-12/h2-5,10,16H,6-9H2,1H3/t16-/m1/s1

HIDE SMILES / InChI

Molecular Formula C17H17ClN6O4
Molecular Weight 404.808
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:12:16 GMT 2023
Edited
by admin
on Sat Dec 16 11:12:16 GMT 2023
Record UNII
4DTJ5E8AE8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ZOPICLONE N-OXIDE, (-)-
Common Name English
1-PIPERAZINECARBOXYLIC ACID, 4-METHYL-, (5R)-6-(5-CHLORO-2-PYRIDINYL)-6,7-DIHYDRO-7-OXO-5H-PYRROLO(3,4-B)PYRAZIN-5-YL ESTER, 4-OXIDE
Systematic Name English
(5R)-6-(5-CHLOROPYRIDIN-2-YL)-7-OXO-6,7-DIHYDRO-5H-PYRROLO(3,4-B)PYRAZIN-5-YL 4-METHYLPIPERAZINE-1-CARBOXYLATE 4-OXIDE
Systematic Name English
Code System Code Type Description
CAS
151851-69-3
Created by admin on Sat Dec 16 11:12:16 GMT 2023 , Edited by admin on Sat Dec 16 11:12:16 GMT 2023
PRIMARY
PUBCHEM
40580554
Created by admin on Sat Dec 16 11:12:16 GMT 2023 , Edited by admin on Sat Dec 16 11:12:16 GMT 2023
PRIMARY
FDA UNII
4DTJ5E8AE8
Created by admin on Sat Dec 16 11:12:16 GMT 2023 , Edited by admin on Sat Dec 16 11:12:16 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER