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Details

Stereochemistry ABSOLUTE
Molecular Formula C25H33ClN2O2
Molecular Weight 428.995
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LOBUPROFEN, (S)-

SMILES

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

InChI

InChIKey=JFGXBHHLHQAGRR-FQEVSTJZSA-N
InChI=1S/C25H33ClN2O2/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/t20-/m0/s1

HIDE SMILES / InChI

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 11:18:31 GMT 2023
Edited
by admin
on Sat Dec 16 11:18:31 GMT 2023
Record UNII
8IOX5K751D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LOBUPROFEN, (S)-
Common Name English
BENZENEACETIC ACID, .ALPHA.-METHYL-4-(2-METHYLPROPYL)-, 2-(4-(3-CHLOROPHENYL)-1-PIPERAZINYL)ETHYL ESTER, (S)-
Systematic Name English
Code System Code Type Description
FDA UNII
8IOX5K751D
Created by admin on Sat Dec 16 11:18:31 GMT 2023 , Edited by admin on Sat Dec 16 11:18:31 GMT 2023
PRIMARY
PUBCHEM
76971052
Created by admin on Sat Dec 16 11:18:31 GMT 2023 , Edited by admin on Sat Dec 16 11:18:31 GMT 2023
PRIMARY
Related Record Type Details
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