U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C17H14ClIO3
Molecular Weight 428.649
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (2-Chloro-5-iodophenyl)[4-[[(3S)-tetrahydro-3-furanyl]oxy]phenyl]methanone

SMILES

ClC1=C(C=C(I)C=C1)C(=O)C2=CC=C(O[C@H]3CCOC3)C=C2

InChI

InChIKey=WBBJCIOCSVFCNI-AWEZNQCLSA-N
InChI=1S/C17H14ClIO3/c18-16-6-3-12(19)9-15(16)17(20)11-1-4-13(5-2-11)22-14-7-8-21-10-14/h1-6,9,14H,7-8,10H2/t14-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
(2-Chloro-5-iodophenyl)[4-[[(3S)-tetrahydro-3-furanyl]oxy]phenyl]methanone
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID50893823
Created by admin on Sat Dec 16 19:34:12 GMT 2023 , Edited by admin on Sat Dec 16 19:34:12 GMT 2023
PRIMARY
CAS
915095-87-3
Created by admin on Sat Dec 16 19:34:12 GMT 2023 , Edited by admin on Sat Dec 16 19:34:12 GMT 2023
PRIMARY
PUBCHEM
59423635
Created by admin on Sat Dec 16 19:34:12 GMT 2023 , Edited by admin on Sat Dec 16 19:34:12 GMT 2023
PRIMARY
FDA UNII
H38Q3VE2C8
Created by admin on Sat Dec 16 19:34:12 GMT 2023 , Edited by admin on Sat Dec 16 19:34:12 GMT 2023
PRIMARY