4-[3-fluoranyl-5-(phenylmethylsulfanyl)phenyl]oxan-4-ol

Systemtic Name: 4-[3-fluoranyl-5-(phenylmethylsulfanyl)phenyl]oxan-4-ol Openeye Name: 4-(3-benzylsulfanyl-5-fluoro-phenyl)tetrahydropyran-4-ol CAS Name: 4-[3-fluoro-5-(phenylmethylthio)phenyl]-4-oxanol IUPAC Name: 4-(3-benzylsulfanyl-5-fluorophenyl)oxan-4-ol Traditional Name: 4-[3-(benzylthio)-5-fluoro-phenyl]tetrahydropyran-4-ol Formula: C18H19FO2S MolecularWeight: 318.405663

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C2=CC(=CC(=C2)SCC3=CC=CC=C3)F)O

Isomeric SMILES

C1COCCC1(C2=CC(=CC(=C2)SCC3=CC=CC=C3)F)O

InChI

InChI=1S/C18H19FO2S/c19-16-10-15(18(20)6-8-21-9-7-18)11-17(12-16)22-13-14-4-2-1-3-5-14/h1-5,10-12,20H,6-9,13H2