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Details

Stereochemistry ACHIRAL
Molecular Formula C16H13BrO3
Molecular Weight 333.177
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of (E)-3-(3-BROMOPHENYL)-1-(2-HYDROXY-6-METHOXY-PHENYL)PROP-2-EN-1-ONE

SMILES

COC1=CC=CC(O)=C1C(=O)\C=C\C2=CC(Br)=CC=C2

InChI

InChIKey=KJEURSMXUHSJST-CMDGGOBGSA-N
InChI=1S/C16H13BrO3/c1-20-15-7-3-6-13(18)16(15)14(19)9-8-11-4-2-5-12(17)10-11/h2-10,18H,1H3/b9-8+

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
(E)-3-(3-BROMOPHENYL)-1-(2-HYDROXY-6-METHOXY-PHENYL)PROP-2-EN-1-ONE
Systematic Name English
2-PROPEN-1-ONE, 3-(3-BROMOPHENYL)-1-(2-HYDROXY-6-METHOXYPHENYL)-, (2E)-
Preferred Name English
Code System Code Type Description
PUBCHEM
16129398
Created by admin on Mon Mar 31 22:38:34 GMT 2025 , Edited by admin on Mon Mar 31 22:38:34 GMT 2025
PRIMARY
CAS
1251022-28-2
Created by admin on Mon Mar 31 22:38:34 GMT 2025 , Edited by admin on Mon Mar 31 22:38:34 GMT 2025
PRIMARY
FDA UNII
0E46ZD59N1
Created by admin on Mon Mar 31 22:38:34 GMT 2025 , Edited by admin on Mon Mar 31 22:38:34 GMT 2025
PRIMARY
NIH
NCATS
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