1,1,1-tris(fluoranyl)-3-octylsulfanyl-3-phenyl-propan-2-one

Systemtic Name: 1,1,1-tris(fluoranyl)-3-octylsulfanyl-3-phenyl-propan-2-one Openeye Name: 1,1,1-trifluoro-3-octylsulfanyl-3-phenyl-propan-2-one CAS Name: 1,1,1-trifluoro-3-(octylthio)-3-phenyl-2-propanone IUPAC Name: 1,1,1-trifluoro-3-octylsulfanyl-3-phenylpropan-2-one Traditional Name: 1,1,1-trifluoro-3-(octylthio)-3-phenyl-acetone Formula: C17H23F3OS MolecularWeight: 332.42413

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC(C1=CC=CC=C1)C(=O)C(F)(F)F

Isomeric SMILES

CCCCCCCCSC(C1=CC=CC=C1)C(=O)C(F)(F)F

InChI

InChI=1S/C17H23F3OS/c1-2-3-4-5-6-10-13-22-15(16(21)17(18,19)20)14-11-8-7-9-12-14/h7-9,11-12,15H,2-6,10,13H2,1H3