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Details

Stereochemistry ACHIRAL
Molecular Formula C12H14O5
Molecular Weight 238.2366
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(4-ACETYL-2-METHOXYPHENOXY)PROPANOIC ACID

SMILES

COC1=CC(=CC=C1OCCC(O)=O)C(C)=O

InChI

InChIKey=GZCAZDATCFYBEF-UHFFFAOYSA-N
InChI=1S/C12H14O5/c1-8(13)9-3-4-10(11(7-9)16-2)17-6-5-12(14)15/h3-4,7H,5-6H2,1-2H3,(H,14,15)

HIDE SMILES / InChI

Approval Year

Name Type Language
ILOPERIDONE METABOLITE P20.8
Preferred Name English
3-(4-ACETYL-2-METHOXYPHENOXY)PROPANOIC ACID
Systematic Name English
PROPANOIC ACID, 3-(4-ACETYL-2-METHOXYPHENOXY)-
Systematic Name English
Code System Code Type Description
CAS
170170-51-1
Created by admin on Wed Apr 02 05:04:39 GMT 2025 , Edited by admin on Wed Apr 02 05:04:39 GMT 2025
PRIMARY
FDA UNII
2EJ7I13S0K
Created by admin on Wed Apr 02 05:04:39 GMT 2025 , Edited by admin on Wed Apr 02 05:04:39 GMT 2025
PRIMARY
PUBCHEM
16773749
Created by admin on Wed Apr 02 05:04:39 GMT 2025 , Edited by admin on Wed Apr 02 05:04:39 GMT 2025
PRIMARY