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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H20N2O2
Molecular Weight 248.3208
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUNITROLOL, (R)-

SMILES

CC(C)(C)NC[C@@H](O)COC1=C(C=CC=C1)C#N

InChI

InChIKey=VCVQSRCYSKKPBA-GFCCVEGCSA-N
InChI=1S/C14H20N2O2/c1-14(2,3)16-9-12(17)10-18-13-7-5-4-6-11(13)8-15/h4-7,12,16-17H,9-10H2,1-3H3/t12-/m1/s1

HIDE SMILES / InChI

Molecular Formula C14H20N2O2
Molecular Weight 248.3208
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 08:30:46 GMT 2023
Edited
by admin
on Sat Dec 16 08:30:46 GMT 2023
Record UNII
Z3894G84FU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BUNITROLOL, (R)-
Common Name English
(+)-BUNITROLOL
Common Name English
BENZONITRILE, 2-(3-((1,1-DIMETHYLETHYL)AMINO)-2-HYDROXYPROPOXY)-, (R)-
Systematic Name English
(R)-BUNITROLOL
Common Name English
BENZONITRILE, 2-((2R)-3-((1,1-DIMETHYLETHYL)AMINO)-2-HYDROXYPROPOXY)-
Systematic Name English
Code System Code Type Description
FDA UNII
Z3894G84FU
Created by admin on Sat Dec 16 08:30:46 GMT 2023 , Edited by admin on Sat Dec 16 08:30:46 GMT 2023
PRIMARY
PUBCHEM
72710712
Created by admin on Sat Dec 16 08:30:46 GMT 2023 , Edited by admin on Sat Dec 16 08:30:46 GMT 2023
PRIMARY
CAS
46905-83-3
Created by admin on Sat Dec 16 08:30:46 GMT 2023 , Edited by admin on Sat Dec 16 08:30:46 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER