Oxybutynin
CAS Registry Number®
5633-20-5
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CAS Name
OxybutyninMolecular Formula
C22H31NO3Molecular Mass
357.49Cite this Page
Oxybutynin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=5633-20-5 (retrieved ) (CAS RN: 5633-20-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
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
InChIKey
InChIKey=XIQVNETUBQGFHX-UHFFFAOYSA-N
SMILES
C(C(OCC#CCN(CC)CC)=O)(O)(C1CCCCC1)C2=CC=CC=C2
Canonical SMILES
O=C(OCC#CCN(CC)CC)C(O)(C=1C=CC=CC1)C2CCCCC2
Other Names for this Substance
- Benzeneacetic acid, α-cyclohexyl-α-hydroxy-, 4-(diethylamino)-2-butyn-1-yl ester
- Cyclohexaneglycolic acid, α-phenyl-, 4-(diethylamino)-2-butynyl ester
- Benzeneacetic acid, α-cyclohexyl-α-hydroxy-, 4-(diethylamino)-2-butynyl ester
- 2-Butyn-1-ol, 4-(diethylamino)-, α-phenylcyclohexaneglycolate (ester)
- 4-Diethylamino-2-butynyl α-phenylcyclohexaneglycolate
Deleted or Replaced CAS Registry Numbers
119579-36-1, 1552323-10-0
