6-oxidanylidene-6-[4-(trifluoromethyl)phenyl]hexanenitrile

Systemtic Name: 6-oxidanylidene-6-[4-(trifluoromethyl)phenyl]hexanenitrile Openeye Name: 6-oxo-6-[4-(trifluoromethyl)phenyl]hexanenitrile CAS Name: 6-oxo-6-[4-(trifluoromethyl)phenyl]hexanenitrile IUPAC Name: 6-oxo-6-[4-(trifluoromethyl)phenyl]hexanenitrile Traditional Name: 6-keto-6-[4-(trifluoromethyl)phenyl]hexanenitrile Formula: C13H12F3NO MolecularWeight: 255.23569

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCCCC#N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCCCC#N)C(F)(F)F

InChI

InChI=1S/C13H12F3NO/c14-13(15,16)11-7-5-10(6-8-11)12(18)4-2-1-3-9-17/h5-8H,1-4H2