2,2-bis[3-(trifluoromethyl)phenyl]ethanenitrile

Systemtic Name: 2,2-bis[3-(trifluoromethyl)phenyl]ethanenitrile Openeye Name: 2,2-bis[3-(trifluoromethyl)phenyl]acetonitrile CAS Name: 2,2-bis[3-(trifluoromethyl)phenyl]acetonitrile IUPAC Name: 2,2-bis[3-(trifluoromethyl)phenyl]acetonitrile Traditional Name: 2,2-bis[3-(trifluoromethyl)phenyl]acetonitrile Formula: C16H9F6N MolecularWeight: 329.239779

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)C(C#N)C2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)C(C#N)C2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C16H9F6N/c17-15(18,19)12-5-1-3-10(7-12)14(9-23)11-4-2-6-13(8-11)16(20,21)22/h1-8,14H