ethyl 2-[4-[3-fluoranyl-5-(4-methoxyoxan-4-yl)phenyl]sulfanylphenyl]-2-oxidanylidene-ethanoate

Systemtic Name: ethyl 2-[4-[3-fluoranyl-5-(4-methoxyoxan-4-yl)phenyl]sulfanylphenyl]-2-oxidanylidene-ethanoate Openeye Name: ethyl 2-[4-[3-fluoro-5-(4-methoxytetrahydropyran-4-yl)phenyl]sulfanylphenyl]-2-oxo-acetate CAS Name: 2-[4-[[3-fluoro-5-(4-methoxy-4-oxanyl)phenyl]thio]phenyl]-2-oxoacetic acid ethyl ester IUPAC Name: ethyl 2-[4-[3-fluoro-5-(4-methoxyoxan-4-yl)phenyl]sulfanylphenyl]-2-oxoacetate Traditional Name: 2-[4-[[3-fluoro-5-(4-methoxytetrahydropyran-4-yl)phenyl]thio]phenyl]-2-keto-acetic acid ethyl ester Formula: C22H23FO5S MolecularWeight: 418.478423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)C1=CC=C(C=C1)SC2=CC(=CC(=C2)F)C3(CCOCC3)OC

Isomeric SMILES

CCOC(=O)C(=O)C1=CC=C(C=C1)SC2=CC(=CC(=C2)F)C3(CCOCC3)OC

InChI

InChI=1S/C22H23FO5S/c1-3-28-21(25)20(24)15-4-6-18(7-5-15)29-19-13-16(12-17(23)14-19)22(26-2)8-10-27-11-9-22/h4-7,12-14H,3,8-11H2,1-2H3