(1-phenyl-2-phenylsulfanyl-ethyl) 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: (1-phenyl-2-phenylsulfanyl-ethyl) 2,2,2-tris(fluoranyl)ethanoate Openeye Name: (1-phenyl-2-phenylsulfanyl-ethyl) 2,2,2-trifluoroacetate CAS Name: 2,2,2-trifluoroacetic acid [1-phenyl-2-(phenylthio)ethyl] ester IUPAC Name: (1-phenyl-2-phenylsulfanylethyl) 2,2,2-trifluoroacetate Traditional Name: 2,2,2-trifluoroacetic acid [1-phenyl-2-(phenylthio)ethyl] ester Formula: C16H13F3O2S MolecularWeight: 326.33343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CSC2=CC=CC=C2)OC(=O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C(CSC2=CC=CC=C2)OC(=O)C(F)(F)F

InChI

InChI=1S/C16H13F3O2S/c17-16(18,19)15(20)21-14(12-7-3-1-4-8-12)11-22-13-9-5-2-6-10-13/h1-10,14H,11H2