(4-cyano-2-methoxy-phenyl) 2-[bis(fluoranyl)methylsulfanyl]benzoate

Systemtic Name: (4-cyano-2-methoxy-phenyl) 2-[bis(fluoranyl)methylsulfanyl]benzoate Openeye Name: (4-cyano-2-methoxy-phenyl) 2-(difluoromethylsulfanyl)benzoate CAS Name: 2-(difluoromethylthio)benzoic acid (4-cyano-2-methoxyphenyl) ester IUPAC Name: (4-cyano-2-methoxyphenyl) 2-(difluoromethylsulfanyl)benzoate Traditional Name: 2-(difluoromethylthio)benzoic acid (4-cyano-2-methoxy-phenyl) ester Formula: C16H11F2NO3S MolecularWeight: 335.325246

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)OC(=O)C2=CC=CC=C2SC(F)F

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)OC(=O)C2=CC=CC=C2SC(F)F

InChI

InChI=1S/C16H11F2NO3S/c1-21-13-8-10(9-19)6-7-12(13)22-15(20)11-4-2-3-5-14(11)23-16(17)18/h2-8,16H,1H3