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Details

Stereochemistry RACEMIC
Molecular Formula C19H16FNO2
Molecular Weight 309.3342
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(4-FLUOROPHENYL)-1-(4-OXOBUTYL)-3H-ISOBENZOFURAN-5-CARBONITRILE

SMILES

FC1=CC=C(C=C1)C2(CCCC=O)OCC3=CC(=CC=C23)C#N

InChI

InChIKey=GTEPDOSDTSBSHH-UHFFFAOYSA-N
InChI=1S/C19H16FNO2/c20-17-6-4-16(5-7-17)19(9-1-2-10-22)18-8-3-14(12-21)11-15(18)13-23-19/h3-8,10-11H,1-2,9,13H2

HIDE SMILES / InChI

Molecular Formula C19H16FNO2
Molecular Weight 309.3342
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:16:45 GMT 2023
Edited
by admin
on Sat Dec 16 14:16:45 GMT 2023
Record UNII
M29NF68JC8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(4-FLUOROPHENYL)-1-(4-OXOBUTYL)-3H-ISOBENZOFURAN-5-CARBONITRILE
Common Name English
Code System Code Type Description
PUBCHEM
165411949
Created by admin on Sat Dec 16 14:16:45 GMT 2023 , Edited by admin on Sat Dec 16 14:16:45 GMT 2023
PRIMARY
FDA UNII
M29NF68JC8
Created by admin on Sat Dec 16 14:16:45 GMT 2023 , Edited by admin on Sat Dec 16 14:16:45 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE