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Details

Stereochemistry ABSOLUTE
Molecular Formula C29H30FN3O
Molecular Weight 455.5664
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0
Stereo Comments ASSUMED R FROM AZELASTINE OPTICAL ROTATION AND BIOACTIVITY

SHOW SMILES / InChI
Structure of FLEZELASTINE, (-)-

SMILES

FC1=CC=C(CC2=NN([C@@H]3CCCN(CCC4=CC=CC=C4)CC3)C(=O)C5=C2C=CC=C5)C=C1

InChI

InChIKey=HQFSNUYUXXPVKL-RUZDIDTESA-N
InChI=1S/C29H30FN3O/c30-24-14-12-23(13-15-24)21-28-26-10-4-5-11-27(26)29(34)33(31-28)25-9-6-18-32(20-17-25)19-16-22-7-2-1-3-8-22/h1-5,7-8,10-15,25H,6,9,16-21H2/t25-/m1/s1

HIDE SMILES / InChI

Molecular Formula C29H30FN3O
Molecular Weight 455.5664
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 Fri Dec 15 20:23:20 GMT 2023
Edited
by admin
on Fri Dec 15 20:23:20 GMT 2023
Record UNII
YT7JWK8OC5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FLEZELASTINE, (-)-
Common Name English
(-)-4-((4-FLUOROPHENYL)METHYL)-2-(HEXAHYDRO-1-(2-PHENYLETHYL)-1H-AZEPIN-4-YL)-1(2H)-PHTHALAZINONE
Common Name English
(-)-FLEZELASTINE
Common Name English
1(2H)-PHTHALAZINONE, 4-((4-FLUOROPHENYL)METHYL)-2-(HEXAHYDRO-1-(2-PHENYLETHYL)-1H-AZEPIN-4-YL)-, (-)-
Systematic Name English
Code System Code Type Description
PUBCHEM
76961011
Created by admin on Fri Dec 15 20:23:20 GMT 2023 , Edited by admin on Fri Dec 15 20:23:20 GMT 2023
PRIMARY PUBCHEM
CAS
153408-35-6
Created by admin on Fri Dec 15 20:23:20 GMT 2023 , Edited by admin on Fri Dec 15 20:23:20 GMT 2023
PRIMARY
FDA UNII
YT7JWK8OC5
Created by admin on Fri Dec 15 20:23:20 GMT 2023 , Edited by admin on Fri Dec 15 20:23:20 GMT 2023
PRIMARY
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