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Details

Stereochemistry ACHIRAL
Molecular Formula C16H13ClO3
Molecular Weight 288.726
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of (E)-1-(4'-CHLOROPHENYL)-3-(4-HYDROXY-3-METHOXYPHENYL)PROP-2-EN-1-ONE

SMILES

COC1=CC(\C=C\C(=O)C2=CC=C(Cl)C=C2)=CC=C1O

InChI

InChIKey=KCTNGNPVURILGU-KRXBUXKQSA-N
InChI=1S/C16H13ClO3/c1-20-16-10-11(3-9-15(16)19)2-8-14(18)12-4-6-13(17)7-5-12/h2-10,19H,1H3/b8-2+

HIDE SMILES / InChI

Molecular Formula C16H13ClO3
Molecular Weight 288.726
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Substance Class Chemical
Created
by admin
on Tue Apr 01 21:06:09 GMT 2025
Edited
by admin
on Tue Apr 01 21:06:09 GMT 2025
Record UNII
RIK7LYIOUJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(E)-1-(4'-CHLOROPHENYL)-3-(4-HYDROXY-3-METHOXYPHENYL)PROP-2-EN-1-ONE
Systematic Name English
(E)-1-(4'-CHLOROPHENYL)-3-(4-HYDROXY-3-METOXYPHENYL)PROP-2-EN-1-ONE
Preferred Name English
2-PROPEN-1-ONE, 1-(4-CHLOROPHENYL)-3-(4-HYDROXY-3-METHOXYPHENYL)-, (2E)-
Systematic Name English
Code System Code Type Description
SMS_ID
100000181852
Created by admin on Tue Apr 01 21:06:09 GMT 2025 , Edited by admin on Tue Apr 01 21:06:09 GMT 2025
PRIMARY
EVMPD
SUB195706
Created by admin on Tue Apr 01 21:06:09 GMT 2025 , Edited by admin on Tue Apr 01 21:06:09 GMT 2025
PRIMARY
CAS
152809-69-3
Created by admin on Tue Apr 01 21:06:09 GMT 2025 , Edited by admin on Tue Apr 01 21:06:09 GMT 2025
PRIMARY
FDA UNII
RIK7LYIOUJ
Created by admin on Tue Apr 01 21:06:09 GMT 2025 , Edited by admin on Tue Apr 01 21:06:09 GMT 2025
PRIMARY
EU-Orphan Drug
EU/3/14/1384
Created by admin on Tue Apr 01 21:06:09 GMT 2025 , Edited by admin on Tue Apr 01 21:06:09 GMT 2025
PRIMARY
PUBCHEM
5708903
Created by admin on Tue Apr 01 21:06:09 GMT 2025 , Edited by admin on Tue Apr 01 21:06:09 GMT 2025
PRIMARY