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

Details

Stereochemistry UNKNOWN
Molecular Formula C14H20N4O
Molecular Weight 260.3348
Optical Activity ( + )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IROXANADINE, (+)-

SMILES

C(C1CONC(=N1)C2=CC=CN=C2)N3CCCCC3

InChI

InChIKey=QWVRTSZDKPRPDF-UHFFFAOYSA-N
InChI=1S/C14H20N4O/c1-2-7-18(8-3-1)10-13-11-19-17-14(16-13)12-5-4-6-15-9-12/h4-6,9,13H,1-3,7-8,10-11H2,(H,16,17)

HIDE SMILES / InChI

Molecular Formula C14H20N4O
Molecular Weight 260.3348
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 09:17:31 UTC 2023
Edited
by admin
on Sat Dec 16 09:17:31 UTC 2023
Record UNII
3JD92A4CWW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IROXANADINE, (+)-
Common Name English
2H-1,2,4-OXADIAZINE, 5,6-DIHYDRO-5-(1-PIPERIDINYLMETHYL)-3-(3-PYRIDINYL)-, (+)-
Systematic Name English
(+)-5,6-DIHYDRO-5-(1-PIPERIDINYLMETHYL)-3-(3-PYRIDINYL)-2H-1,2,4-OXADIAZINE
Common Name English
Code System Code Type Description
FDA UNII
3JD92A4CWW
Created by admin on Sat Dec 16 09:17:32 UTC 2023 , Edited by admin on Sat Dec 16 09:17:32 UTC 2023
PRIMARY
CAS
934838-71-8
Created by admin on Sat Dec 16 09:17:32 UTC 2023 , Edited by admin on Sat Dec 16 09:17:32 UTC 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> ENANTIOMER
SALT/SOLVATE -> PARENT
SALT/SOLVATE -> PARENT
RACEMATE -> ENANTIOMER
SALT/SOLVATE -> PARENT