Bunitrolol Hydrochloride
2-[3-(tert-butylamino)-2-hydroxypropoxy]benzonitrile;hydrochloride
Molecular Identity
Bunitrolol Hydrochloride
2-[3-(tert-butylamino)-2-hydroxypropoxy]benzonitrile;hydrochloride
PubChem CID: 13477019
Bunitrolol hydrochloride is an aromatic ether.
2D Structure
Properties
C14H21ClN2O2
Molecular Formula
284.78
Molecular Weight
g/mol
284.1292
Exact Mass
Da
65.3
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
4
H-Bond Acceptors
290
Complexity
SMILES
Canonical SMILES
SMILES: CC(C)(C)NCC(COC1=CC=CC=C1C#N)O.ClIsomeric SMILES
SMILES: CC(C)(C)NCC(COC1=CC=CC=C1C#N)O.ClSynonyms(20)
bunitrolol hydrochlorideStressonBunitrolol HCl29876-08-223093-74-5BetrilolKo 1366 hydrochlorideUNII-A42VUS2X73A42VUS2X73EINECS 249-920-6Betrilol (TN)Bunitrolol hydrochloride [JAN]KO-1366 HYDROCHLORIDE(1)-2-(3-((tert-Butyl)amino)-2-hydroxypropoxy)benzonitrile monohydrochlorideBunitrolol hydrochloride (JAN)
Data from PubChem (NCBI)
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