2-[4-[bis(fluoranyl)methoxy]phenyl]-3-oxidanylidene-hexanenitrile

Systemtic Name: 2-[4-[bis(fluoranyl)methoxy]phenyl]-3-oxidanylidene-hexanenitrile Openeye Name: 2-[4-(difluoromethoxy)phenyl]-3-oxo-hexanenitrile CAS Name: 2-[4-(difluoromethoxy)phenyl]-3-oxohexanenitrile IUPAC Name: 2-[4-(difluoromethoxy)phenyl]-3-oxohexanenitrile Traditional Name: 2-[4-(difluoromethoxy)phenyl]-3-keto-hexanenitrile Formula: C13H13F2NO2 MolecularWeight: 253.244626

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(C#N)C1=CC=C(C=C1)OC(F)F

Isomeric SMILES

CCCC(=O)C(C#N)C1=CC=C(C=C1)OC(F)F

InChI

InChI=1S/C13H13F2NO2/c1-2-3-12(17)11(8-16)9-4-6-10(7-5-9)18-13(14)15/h4-7,11,13H,2-3H2,1H3