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Details

Stereochemistry ABSOLUTE
Molecular Formula C25H33ClN2O2.ClH
Molecular Weight 465.456
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LOBUPROFEN HYDROCHLORIDE (R)-

SMILES

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

InChI

InChIKey=JVENDESVMMLQIH-VEIFNGETSA-N
InChI=1S/C25H33ClN2O2.ClH/c1-19(2)17-21-7-9-22(10-8-21)20(3)25(29)30-16-15-27-11-13-28(14-12-27)24-6-4-5-23(26)18-24;/h4-10,18-20H,11-17H2,1-3H3;1H/t20-;/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 C25H33ClN2O2
Molecular Weight 428.995
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 10:53:32 GMT 2023
Edited
by admin
on Sat Dec 16 10:53:32 GMT 2023
Record UNII
A03Q1432ZC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LOBUPROFEN HYDROCHLORIDE (R)-
Common Name English
BENZENEACETIC ACID, .ALPHA.-METHYL-4-(2-METHYLPROPYL)-, 2-(4-(3-CHLOROPHENYL)-1-PIPERAZINYL)ETHYL ESTER, HYDROCHLORIDE (1:1), (R)-
Systematic Name English
Code System Code Type Description
FDA UNII
A03Q1432ZC
Created by admin on Sat Dec 16 10:53:32 GMT 2023 , Edited by admin on Sat Dec 16 10:53:32 GMT 2023
PRIMARY
PUBCHEM
76971191
Created by admin on Sat Dec 16 10:53:32 GMT 2023 , Edited by admin on Sat Dec 16 10:53:32 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER