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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H33F3N2O2.ClH
Molecular Weight 499.009
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FRABUPROFEN HYDROCHLORIDE, (S)-

SMILES

Cl.CC(C)CC1=CC=C(C=C1)[C@H](C)C(=O)OCCN2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChIKey=DWLLAIYCNJBOMX-BDQAORGHSA-N
InChI=1S/C26H33F3N2O2.ClH/c1-19(2)17-21-7-9-22(10-8-21)20(3)25(32)33-16-15-30-11-13-31(14-12-30)24-6-4-5-23(18-24)26(27,28)29;/h4-10,18-20H,11-17H2,1-3H3;1H/t20-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C26H33F3N2O2
Molecular Weight 462.5476
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

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

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:28:24 GMT 2023
Edited
by admin
on Sat Dec 16 10:28:24 GMT 2023
Record UNII
8427II6JS2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FRABUPROFEN HYDROCHLORIDE, (S)-
Common Name English
BENZENEACETIC ACID, .ALPHA.-METHYL-4-(2-METHYLPROPYL)-, 2-(4-(3-(TRIFLUOROMETHYL)PHENYL)-1-PIPERAZINYL)ETHYL ESTER, HYDROCHLORIDE (1:1), (S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
121489303
Created by admin on Sat Dec 16 10:28:24 GMT 2023 , Edited by admin on Sat Dec 16 10:28:24 GMT 2023
PRIMARY
FDA UNII
8427II6JS2
Created by admin on Sat Dec 16 10:28:24 GMT 2023 , Edited by admin on Sat Dec 16 10:28:24 GMT 2023
PRIMARY
Related Record Type Details
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