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

Details

Stereochemistry ACHIRAL
Molecular Formula C22H24NO5
Molecular Weight 382.4297
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of AZASPIRIUM

SMILES

COC1=C2OC=CC2=C(OC)C3=C1OC4=C(C[N+]5(CCCCC5)CC4=C)C3=O

InChI

InChIKey=ADITXIOZDFZRAT-UHFFFAOYSA-N
InChI=1S/C22H24NO5/c1-13-11-23(8-5-4-6-9-23)12-15-17(24)16-19(25-2)14-7-10-27-20(14)22(26-3)21(16)28-18(13)15/h7,10H,1,4-6,8-9,11-12H2,2-3H3/q+1

HIDE SMILES / InChI
Name Type Language
AZASPIRIUM
WHO-DD  
Common Name English
SPIRO(5H-FURO(3',2':6,7)(1)BENZOPYRANO(3,2-C)PYRIDINE-7(6H),1'-PIPERIDIN-1'-IUM), 8,9-DIHYDRO-4,11-DIMETHOXY-9-METHYLENE-5-OXO-
Common Name English
AZASPIRIUM CATION
Common Name English
AZASPIRIUM ION
Common Name English
Azaspirium [WHO-DD]
Common Name English
8,9-DIHYDRO-4,11-DIMETHOXY-9-METHYLENE-5-OXOSPIRO(5H-FURO(3',2':6,7)(1)BENZOPYRANO(3,2-C)PYRIDINE-7-(6H),1'-PIPERIDINIUM)
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29712
Created by admin on Fri Dec 15 17:18:00 GMT 2023 , Edited by admin on Fri Dec 15 17:18:00 GMT 2023
Code System Code Type Description
CAS
775517-13-0
Created by admin on Fri Dec 15 17:18:00 GMT 2023 , Edited by admin on Fri Dec 15 17:18:00 GMT 2023
PRIMARY
EPA CompTox
DTXSID00228242
Created by admin on Fri Dec 15 17:18:00 GMT 2023 , Edited by admin on Fri Dec 15 17:18:00 GMT 2023
PRIMARY
PUBCHEM
71937
Created by admin on Fri Dec 15 17:18:00 GMT 2023 , Edited by admin on Fri Dec 15 17:18:00 GMT 2023
PRIMARY
NCI_THESAURUS
C87437
Created by admin on Fri Dec 15 17:18:00 GMT 2023 , Edited by admin on Fri Dec 15 17:18:00 GMT 2023
PRIMARY
FDA UNII
902Q3R1X1U
Created by admin on Fri Dec 15 17:18:00 GMT 2023 , Edited by admin on Fri Dec 15 17:18:00 GMT 2023
PRIMARY