methyl 2,2-bis(fluoranyl)-2-(3-methyl-4-oxidanyl-phenyl)sulfanyl-ethanoate

Systemtic Name: methyl 2,2-bis(fluoranyl)-2-(3-methyl-4-oxidanyl-phenyl)sulfanyl-ethanoate Openeye Name: methyl 2,2-difluoro-2-(4-hydroxy-3-methyl-phenyl)sulfanyl-acetate CAS Name: 2,2-difluoro-2-[(4-hydroxy-3-methylphenyl)thio]acetic acid methyl ester IUPAC Name: methyl 2,2-difluoro-2-(4-hydroxy-3-methylphenyl)sulfanylacetate Traditional Name: 2,2-difluoro-2-[(4-hydroxy-3-methyl-phenyl)thio]acetic acid methyl ester Formula: C10H10F2O3S MolecularWeight: 248.246406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SC(C(=O)OC)(F)F)O

Isomeric SMILES

CC1=C(C=CC(=C1)SC(C(=O)OC)(F)F)O

InChI

InChI=1S/C10H10F2O3S/c1-6-5-7(3-4-8(6)13)16-10(11,12)9(14)15-2/h3-5,13H,1-2H3