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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H26FNO4
Molecular Weight 387.4445
Optical Activity ( + )
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Desfluoro Nebivolol R,R,R,S Diastereomer

SMILES

O[C@H](CNC[C@@H](O)[C@H]1CCC2=C(O1)C=CC=C2)[C@@H]3CCC4=CC(F)=CC=C4O3

InChI

InChIKey=JMAVJQLYDMPPMQ-YHBROIRLSA-N
InChI=1S/C22H26FNO4/c23-16-7-10-20-15(11-16)6-9-22(28-20)18(26)13-24-12-17(25)21-8-5-14-3-1-2-4-19(14)27-21/h1-4,7,10-11,17-18,21-22,24-26H,5-6,8-9,12-13H2/t17-,18-,21-,22+/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H26FNO4
Molecular Weight 387.4445
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:47:09 GMT 2025
Edited
by admin
on Wed Apr 02 19:47:09 GMT 2025
Record UNII
Z6LK5GL69V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(?R,2S)-?-[[[(2R)-2-[(2R)-3,4-Dihydro-2H-1-benzopyran-2-yl]-2-hydroxyethyl]amino]methyl]-6-fluoro-3,4-dihydro-2H-1-benzopyran-2-methanol
Preferred Name English
Desfluoro Nebivolol R,R,R,S Diastereomer
Common Name English
2H-1-Benzopyran-2-methanol, ?-[[[(2R)-2-[(2R)-3,4-dihydro-2H-1-benzopyran-2-yl]-2-hydroxyethyl]amino]methyl]-6-fluoro-3,4-dihydro-, (?R,2S)-
Systematic Name English
Code System Code Type Description
CAS
1696472-15-7
Created by admin on Wed Apr 02 19:47:09 GMT 2025 , Edited by admin on Wed Apr 02 19:47:09 GMT 2025
PRIMARY
FDA UNII
Z6LK5GL69V
Created by admin on Wed Apr 02 19:47:09 GMT 2025 , Edited by admin on Wed Apr 02 19:47:09 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT