(5-cyano-2-fluoranyl-phenyl)methyl 4-[bis(fluoranyl)methylsulfonyl]benzoate

Systemtic Name: (5-cyano-2-fluoranyl-phenyl)methyl 4-[bis(fluoranyl)methylsulfonyl]benzoate Openeye Name: (5-cyano-2-fluoro-phenyl)methyl 4-(difluoromethylsulfonyl)benzoate CAS Name: 4-(difluoromethylsulfonyl)benzoic acid (5-cyano-2-fluorophenyl)methyl ester IUPAC Name: (5-cyano-2-fluorophenyl)methyl 4-(difluoromethylsulfonyl)benzoate Traditional Name: 4-(difluoromethylsulfonyl)benzoic acid (5-cyano-2-fluoro-benzyl) ester Formula: C16H10F3NO4S MolecularWeight: 369.31511

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC2=C(C=CC(=C2)C#N)F)S(=O)(=O)C(F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC2=C(C=CC(=C2)C#N)F)S(=O)(=O)C(F)F

InChI

InChI=1S/C16H10F3NO4S/c17-14-6-1-10(8-20)7-12(14)9-24-15(21)11-2-4-13(5-3-11)25(22,23)16(18)19/h1-7,16H,9H2