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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H31NO3
Molecular Weight 357.4864
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Aroxybutynin

SMILES

CCN(CC)CC#CCOC(=O)[C@@](O)(C1CCCCC1)C2=CC=CC=C2

InChI

InChIKey=XIQVNETUBQGFHX-QFIPXVFZSA-N
InChI=1S/C22H31NO3/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/h5,7-8,13-14,20,25H,3-4,6,9-10,15-18H2,1-2H3/t22-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H31NO3
Molecular Weight 357.4864
Charge 0
Count
Stereochemistry ABSOLUTE
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 19:33:23 UTC 2023
Edited
by admin
on Sat Dec 16 19:33:23 UTC 2023
Record UNII
5BRQ29UUB7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Aroxybutynin
INN  
Official Name English
(-)-OXYBUTYNIN
Common Name English
OXYBUTYNIN, (-)-
Common Name English
4-(diethylamino)but-2-yn-1-yl (R)-cyclohexyl(hydroxy)(phenyl)acetate
Systematic Name English
(R)-OXYBUTYNIN
Common Name English
Benzeneacetic acid, α-cyclohexyl-α-hydroxy-, 4-(diethylamino)-2-butyn-1-yl ester, (αR)-
Systematic Name English
aroxybutynin [INN]
Common Name English
R-OXYBUTYNIN
Common Name English
OXYBUTYNIN, (R)-
Common Name English
Code System Code Type Description
FDA UNII
5BRQ29UUB7
Created by admin on Sat Dec 16 19:33:24 UTC 2023 , Edited by admin on Sat Dec 16 19:33:24 UTC 2023
PRIMARY
CAS
119618-21-2
Created by admin on Sat Dec 16 19:33:24 UTC 2023 , Edited by admin on Sat Dec 16 19:33:24 UTC 2023
PRIMARY
SMS_ID
300000045599
Created by admin on Sat Dec 16 19:33:24 UTC 2023 , Edited by admin on Sat Dec 16 19:33:24 UTC 2023
PRIMARY
INN
12152
Created by admin on Sat Dec 16 19:33:24 UTC 2023 , Edited by admin on Sat Dec 16 19:33:24 UTC 2023
PRIMARY
PUBCHEM
6098167
Created by admin on Sat Dec 16 19:33:24 UTC 2023 , Edited by admin on Sat Dec 16 19:33:24 UTC 2023
PRIMARY
NCI_THESAURUS
C190351
Created by admin on Sat Dec 16 19:33:24 UTC 2023 , Edited by admin on Sat Dec 16 19:33:24 UTC 2023
PRIMARY
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