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Details

Stereochemistry RACEMIC
Molecular Formula C19H31NO2.ClH
Molecular Weight 341.916
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ibuprofen Trelamine Hydrochloride

SMILES

Cl.CCN(CC)CCOC(=O)C(C)C1=CC=C(CC(C)C)C=C1

InChI

InChIKey=CWKBMJZHISTTCK-UHFFFAOYSA-N
InChI=1S/C19H31NO2.ClH/c1-6-20(7-2)12-13-22-19(21)16(5)18-10-8-17(9-11-18)14-15(3)4;/h8-11,15-16H,6-7,12-14H2,1-5H3;1H

HIDE SMILES / InChI

Molecular Formula C19H31NO2
Molecular Weight 305.4549
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

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 11:43:07 UTC 2023
Edited
by admin
on Sat Dec 16 11:43:07 UTC 2023
Record UNII
VAH26D3E8W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Ibuprofen Trelamine Hydrochloride
USAN  
Official Name English
IBUPROFEN TRELAMINE HYDROCHLORIDE [USAN]
Common Name English
TF-X0002
Code English
DIETHYLAMINOETHYL IBUPROFEN HYDROCHLORIDE
Common Name English
IBUPROFEN DIETHYLAMINOETHYL ESTER HYDROCHLORIDE
Common Name English
X-0002
Code English
Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, 2-(diethylamino)ethyl ester, hydrochloride (1:1)
Systematic Name English
2-(Diethylamino)ethyl 2-(4-isobutylphenyl)propanoate hydrochloride
Systematic Name English
X0002
Code English
Code System Code Type Description
FDA UNII
VAH26D3E8W
Created by admin on Sat Dec 16 11:43:07 UTC 2023 , Edited by admin on Sat Dec 16 11:43:07 UTC 2023
PRIMARY
USAN
LM-76
Created by admin on Sat Dec 16 11:43:07 UTC 2023 , Edited by admin on Sat Dec 16 11:43:07 UTC 2023
PRIMARY
CAS
106492-87-9
Created by admin on Sat Dec 16 11:43:07 UTC 2023 , Edited by admin on Sat Dec 16 11:43:07 UTC 2023
PRIMARY
PUBCHEM
23726891
Created by admin on Sat Dec 16 11:43:07 UTC 2023 , Edited by admin on Sat Dec 16 11:43:07 UTC 2023
PRIMARY
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