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

Details

Stereochemistry MIXED
Molecular Formula C22H35NO3
Molecular Weight 361.5182
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-DESPHENYL-.ALPHA.-CYCLOHEXENYL OXYBUTYNIN

SMILES

CCN(CC)CC#CCOC(=O)C(O)(C1CCCCC1)C2CCC=CC2

InChI

InChIKey=JLKIQERNEYLJLA-UHFFFAOYSA-N
InChI=1S/C22H35NO3/c1-3-23(4-2)17-11-12-18-26-21(24)22(25,19-13-7-5-8-14-19)20-15-9-6-10-16-20/h5,7,19-20,25H,3-4,6,8-10,13-18H2,1-2H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
.ALPHA.-DESPHENYL-.ALPHA.-CYCLOHEXENYL OXYBUTYNIN
Common Name English
4-(DIETHYLAMINO)BUT-2-YNYL (±)-2-(CYCLOHEX-3-ENYL)-2-CYCLOHEXYL-2-HYDROXYACETATE
Systematic Name English
OXYBUTYNIN HYDROCHLORIDE IMPURITY A [EP IMPURITY]
Common Name English
4-(DIETHYLAMINO)BUT-2-YNYL (RS)-2-(CYCLOHEX-3-ENYL)-2-CYCLOHEXYL-2-HYDROXYACETATE
Systematic Name English
OXYBUTYNIN CHLORIDE IMPURITY, CYCLOHEXENYL ANALOG OF OXYBUTYNIN CHLORIDE- [USP IMPURITY]
Common Name English
Code System Code Type Description
CAS
1199574-71-4
Created by admin on Sat Dec 16 08:09:22 GMT 2023 , Edited by admin on Sat Dec 16 08:09:22 GMT 2023
PRIMARY
PUBCHEM
72941994
Created by admin on Sat Dec 16 08:09:22 GMT 2023 , Edited by admin on Sat Dec 16 08:09:22 GMT 2023
PRIMARY
FDA UNII
J6ALC99FKD
Created by admin on Sat Dec 16 08:09:22 GMT 2023 , Edited by admin on Sat Dec 16 08:09:22 GMT 2023
PRIMARY
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966