4-[4-[(3-fluorophenyl)methoxy]phenyl]sulfanylbutanoic acid

Systemtic Name: 4-[4-[(3-fluorophenyl)methoxy]phenyl]sulfanylbutanoic acid Openeye Name: 4-[4-[(3-fluorophenyl)methoxy]phenyl]sulfanylbutanoic acid CAS Name: 4-[[4-[(3-fluorophenyl)methoxy]phenyl]thio]butanoic acid IUPAC Name: 4-[4-[(3-fluorophenyl)methoxy]phenyl]sulfanylbutanoic acid Traditional Name: 4-[[4-(3-fluorobenzyl)oxyphenyl]thio]butyric acid Formula: C17H17FO3S MolecularWeight: 320.378483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)COC2=CC=C(C=C2)SCCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)F)COC2=CC=C(C=C2)SCCCC(=O)O

InChI

InChI=1S/C17H17FO3S/c18-14-4-1-3-13(11-14)12-21-15-6-8-16(9-7-15)22-10-2-5-17(19)20/h1,3-4,6-9,11H,2,5,10,12H2,(H,19,20)