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Details

Stereochemistry RACEMIC
Molecular Formula C19H16FNO3
Molecular Weight 325.3336
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-CYANO-1-(4-FLUOROPHENYL)-1,3-DIHYDRO-1-ISOBENZOFURANBUTANOIC ACID

SMILES

OC(=O)CCCC1(OCC2=C1C=CC(=C2)C#N)C3=CC=C(F)C=C3

InChI

InChIKey=FOGQYQBNBJEREZ-UHFFFAOYSA-N
InChI=1S/C19H16FNO3/c20-16-6-4-15(5-7-16)19(9-1-2-18(22)23)17-8-3-13(11-21)10-14(17)12-24-19/h3-8,10H,1-2,9,12H2,(H,22,23)

HIDE SMILES / InChI

Molecular Formula C19H16FNO3
Molecular Weight 325.3336
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 07:09:59 UTC 2023
Edited
by admin
on Sat Dec 16 07:09:59 UTC 2023
Record UNII
DK983N4H8X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-CYANO-1-(4-FLUOROPHENYL)-1,3-DIHYDRO-1-ISOBENZOFURANBUTANOIC ACID
Systematic Name English
1-ISOBENZOFURANBUTANOIC ACID, 5-CYANO-1-(4-FLUOROPHENYL)-1,3-DIHYDRO-
Common Name English
Code System Code Type Description
PUBCHEM
71587640
Created by admin on Sat Dec 16 07:09:59 UTC 2023 , Edited by admin on Sat Dec 16 07:09:59 UTC 2023
PRIMARY
FDA UNII
DK983N4H8X
Created by admin on Sat Dec 16 07:09:59 UTC 2023 , Edited by admin on Sat Dec 16 07:09:59 UTC 2023
PRIMARY
CAS
211800-33-8
Created by admin on Sat Dec 16 07:09:59 UTC 2023 , Edited by admin on Sat Dec 16 07:09:59 UTC 2023
PRIMARY
Related Record Type Details
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