U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C20H24O3
Molecular Weight 312.4028
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METOXIBUTROPATE

SMILES

COC1=C(OC(=O)C(C)C2=CC=C(CC(C)C)C=C2)C=CC=C1

InChI

InChIKey=FVRWRGBTEHAPDI-UHFFFAOYSA-N
InChI=1S/C20H24O3/c1-14(2)13-16-9-11-17(12-10-16)15(3)20(21)23-19-8-6-5-7-18(19)22-4/h5-12,14-15H,13H2,1-4H3

HIDE SMILES / InChI

Approval Year

Name Type Language
METOXIBUTROPATE
Common Name English
IBUPROFEN GUAIACOL ESTER
WHO-DD  
Common Name English
FLUBENIL
Common Name English
AF-2259
Code English
GUAIACOL 4-ISOBUTYLHYDRATROPATE
Systematic Name English
BENZENEACETIC ACID, ALPHA-METHYL-4-(2-METHYLPROPYL)-, 2-METHOXYPHENYL ESTER
Systematic Name English
Ibuprofen guaiacol ester [WHO-DD]
Common Name English
Code System Code Type Description
DRUG CENTRAL
1410
Created by admin on Sat Dec 16 08:39:32 GMT 2023 , Edited by admin on Sat Dec 16 08:39:32 GMT 2023
PRIMARY
CAS
66332-77-2
Created by admin on Sat Dec 16 08:39:32 GMT 2023 , Edited by admin on Sat Dec 16 08:39:32 GMT 2023
PRIMARY
PUBCHEM
4464271
Created by admin on Sat Dec 16 08:39:32 GMT 2023 , Edited by admin on Sat Dec 16 08:39:32 GMT 2023
PRIMARY
FDA UNII
0N623MNK8Z
Created by admin on Sat Dec 16 08:39:32 GMT 2023 , Edited by admin on Sat Dec 16 08:39:32 GMT 2023
PRIMARY
EPA CompTox
DTXSID10984948
Created by admin on Sat Dec 16 08:39:32 GMT 2023 , Edited by admin on Sat Dec 16 08:39:32 GMT 2023
PRIMARY
ECHA (EC/EINECS)
266-318-9
Created by admin on Sat Dec 16 08:39:32 GMT 2023 , Edited by admin on Sat Dec 16 08:39:32 GMT 2023
PRIMARY
EVMPD
SUB31803
Created by admin on Sat Dec 16 08:39:32 GMT 2023 , Edited by admin on Sat Dec 16 08:39:32 GMT 2023
PRIMARY
SMS_ID
100000124225
Created by admin on Sat Dec 16 08:39:32 GMT 2023 , Edited by admin on Sat Dec 16 08:39:32 GMT 2023
PRIMARY