Desfluoro Nebivolol Hydrochloride R,R,R,S Diastereomer

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H26FNO4.ClH
Molecular Weight	423.905
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Desfluoro Nebivolol Hydrochloride R,R,R,S Diastereomer

Structure Search

SMILES

Cl.O[C@H](CNC[C@@H](O)[C@@H]1CCC2=CC(F)=CC=C2O1)[C@H]3CCC4=CC=CC=C4O3

InChI

InChIKey=JQSHBIMNTXOZAO-VCVZPGOSSA-N

InChI=1S/C22H26FNO4.ClH/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;1H/t17-,18-,21-,22+;/m1./s1

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

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 19:42:20 GMT 2025` Edited by `admin` on `Wed Apr 02 19:42:20 GMT 2025`
Record UNII	668NN8FJ44
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Desfluoro Nebivolol Hydrochloride 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-, hydrochloride (1:1), (?R,2S)-

Preferred Name

English

Code System Code Type Description

FDA UNII

668NN8FJ44

Created by admin on Wed Apr 02 19:42:20 GMT 2025 , Edited by admin on Wed Apr 02 19:42:20 GMT 2025

PRIMARY

CAS

1696430-23-5

Created by admin on Wed Apr 02 19:42:20 GMT 2025 , Edited by admin on Wed Apr 02 19:42:20 GMT 2025

PRIMARY

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Desfluoro Nebivolol R,R,R,S Diastereomer

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