phenacyl 2-[[4-[bis(fluoranyl)methylsulfanyl]phenyl]amino]benzoate

Systemtic Name: phenacyl 2-[[4-[bis(fluoranyl)methylsulfanyl]phenyl]amino]benzoate Openeye Name: phenacyl 2-[4-(difluoromethylsulfanyl)anilino]benzoate CAS Name: 2-[4-(difluoromethylthio)anilino]benzoic acid phenacyl ester IUPAC Name: phenacyl 2-[4-(difluoromethylsulfanyl)anilino]benzoate Traditional Name: 2-[4-(difluoromethylthio)anilino]benzoic acid phenacyl ester Formula: C22H17F2NO3S MolecularWeight: 413.437086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2NC3=CC=C(C=C3)SC(F)F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2NC3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C22H17F2NO3S/c23-22(24)29-17-12-10-16(11-13-17)25-19-9-5-4-8-18(19)21(27)28-14-20(26)15-6-2-1-3-7-15/h1-13,22,25H,14H2