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Details

Stereochemistry ACHIRAL
Molecular Formula C19H18O3
Molecular Weight 294.3444
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (2-butylbenzofuran-3-yl)(4-hydroxyphenyl)methanone

SMILES

CCCCC1=C(C(=O)C2=CC=C(O)C=C2)C3=C(O1)C=CC=C3

InChI

InChIKey=ZHGKQUXXASLVQQ-UHFFFAOYSA-N
InChI=1S/C19H18O3/c1-2-3-7-17-18(15-6-4-5-8-16(15)22-17)19(21)13-9-11-14(20)12-10-13/h4-6,8-12,20H,2-3,7H2,1H3

HIDE SMILES / InChI

Molecular Formula C19H18O3
Molecular Weight 294.3444
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
0.54 µM [IC50]
Substance Class Chemical
Created
by admin
on Sat Dec 16 07:38:12 GMT 2023
Edited
by admin
on Sat Dec 16 07:38:12 GMT 2023
Record UNII
7PK1H9HDST
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(2-butylbenzofuran-3-yl)(4-hydroxyphenyl)methanone
Systematic Name English
AMIODARONE RELATED COMPOUND E [USP-RS]
Common Name English
2-BUTYL-3-(4-HYDROXYBENZOYL)BENZOFURAN
Systematic Name English
NSC-85438
Code English
AMIODARONE HYDROCHLORIDE IMPURITY E [EP IMPURITY]
Common Name English
METHANONE, (2-BUTYL-3-BENZOFURANYL)(4-HYDROXYPHENYL)-
Systematic Name English
L-3372
Common Name English
KETONE, 2-BUTYL-3-BENZOFURANYL P-HYDROXYPHENYL
Common Name English
Code System Code Type Description
NSC
85438
Created by admin on Sat Dec 16 07:38:12 GMT 2023 , Edited by admin on Sat Dec 16 07:38:12 GMT 2023
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FDA UNII
7PK1H9HDST
Created by admin on Sat Dec 16 07:38:12 GMT 2023 , Edited by admin on Sat Dec 16 07:38:12 GMT 2023
PRIMARY
EPA CompTox
DTXSID40200486
Created by admin on Sat Dec 16 07:38:12 GMT 2023 , Edited by admin on Sat Dec 16 07:38:12 GMT 2023
PRIMARY
PUBCHEM
96670
Created by admin on Sat Dec 16 07:38:12 GMT 2023 , Edited by admin on Sat Dec 16 07:38:12 GMT 2023
PRIMARY
CAS
52490-15-0
Created by admin on Sat Dec 16 07:38:12 GMT 2023 , Edited by admin on Sat Dec 16 07:38:12 GMT 2023
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RS_ITEM_NUM
1027357
Created by admin on Sat Dec 16 07:38:12 GMT 2023 , Edited by admin on Sat Dec 16 07:38:12 GMT 2023
PRIMARY
ECHA (EC/EINECS)
257-959-5
Created by admin on Sat Dec 16 07:38:12 GMT 2023 , Edited by admin on Sat Dec 16 07:38:12 GMT 2023
PRIMARY
Related Record Type Details
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