3-sulfanyl-2,6-bis[2,2,2-tris(fluoranyl)ethoxy]benzenecarbonitrile

Systemtic Name: 3-sulfanyl-2,6-bis[2,2,2-tris(fluoranyl)ethoxy]benzenecarbonitrile Openeye Name: 3-sulfanyl-2,6-bis(2,2,2-trifluoroethoxy)benzonitrile CAS Name: 3-mercapto-2,6-bis(2,2,2-trifluoroethoxy)benzonitrile IUPAC Name: 3-sulfanyl-2,6-bis(2,2,2-trifluoroethoxy)benzonitrile Traditional Name: 3-mercapto-2,6-bis(2,2,2-trifluoroethoxy)benzonitrile Formula: C11H7F6NO2S MolecularWeight: 331.234199

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1OCC(F)(F)F)C#N)OCC(F)(F)F)S

Isomeric SMILES

C1=CC(=C(C(=C1OCC(F)(F)F)C#N)OCC(F)(F)F)S

InChI

InChI=1S/C11H7F6NO2S/c12-10(13,14)4-19-7-1-2-8(21)9(6(7)3-18)20-5-11(15,16)17/h1-2,21H,4-5H2