2-(2-chloranyl-6-fluoranyl-phenyl)-4-ethyl-3-oxidanylidene-octanenitrile

Systemtic Name: 2-(2-chloranyl-6-fluoranyl-phenyl)-4-ethyl-3-oxidanylidene-octanenitrile Openeye Name: 2-(2-chloro-6-fluoro-phenyl)-4-ethyl-3-oxo-octanenitrile CAS Name: 2-(2-chloro-6-fluorophenyl)-4-ethyl-3-oxooctanenitrile IUPAC Name: 2-(2-chloro-6-fluorophenyl)-4-ethyl-3-oxooctanenitrile Traditional Name: 2-(2-chloro-6-fluoro-phenyl)-4-ethyl-3-keto-caprylonitrile Formula: C16H19ClFNO MolecularWeight: 295.779563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)C(C#N)C1=C(C=CC=C1Cl)F

Isomeric SMILES

CCCCC(CC)C(=O)C(C#N)C1=C(C=CC=C1Cl)F

InChI

InChI=1S/C16H19ClFNO/c1-3-5-7-11(4-2)16(20)12(10-19)15-13(17)8-6-9-14(15)18/h6,8-9,11-12H,3-5,7H2,1-2H3