2-ethyl-6,6,6-tris(fluoranyl)-2-phenyl-5,5-bis(trifluoromethyl)hex-3-ynenitrile

Systemtic Name: 2-ethyl-6,6,6-tris(fluoranyl)-2-phenyl-5,5-bis(trifluoromethyl)hex-3-ynenitrile Openeye Name: 2-ethyl-6,6,6-trifluoro-2-phenyl-5,5-bis(trifluoromethyl)hex-3-ynenitrile CAS Name: 2-ethyl-6,6,6-trifluoro-2-phenyl-5,5-bis(trifluoromethyl)-3-hexynenitrile IUPAC Name: 2-ethyl-6,6,6-trifluoro-2-phenyl-5,5-bis(trifluoromethyl)hex-3-ynenitrile Traditional Name: 2-ethyl-6,6,6-trifluoro-2-phenyl-5,5-bis(trifluoromethyl)hex-3-ynenitrile Formula: C16H10F9N MolecularWeight: 387.242929

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#CC(C(F)(F)F)(C(F)(F)F)C(F)(F)F)(C#N)C1=CC=CC=C1

Isomeric SMILES

CCC(C#CC(C(F)(F)F)(C(F)(F)F)C(F)(F)F)(C#N)C1=CC=CC=C1

InChI

InChI=1S/C16H10F9N/c1-2-12(10-26,11-6-4-3-5-7-11)8-9-13(14(17,18)19,15(20,21)22)16(23,24)25/h3-7H,2H2,1H3