2-(2-chloranyl-6-fluoranyl-phenyl)-5-ethoxy-3-oxidanylidene-pentanenitrile

Systemtic Name: 2-(2-chloranyl-6-fluoranyl-phenyl)-5-ethoxy-3-oxidanylidene-pentanenitrile Openeye Name: 2-(2-chloro-6-fluoro-phenyl)-5-ethoxy-3-oxo-pentanenitrile CAS Name: 2-(2-chloro-6-fluorophenyl)-5-ethoxy-3-oxopentanenitrile IUPAC Name: 2-(2-chloro-6-fluorophenyl)-5-ethoxy-3-oxopentanenitrile Traditional Name: 2-(2-chloro-6-fluoro-phenyl)-5-ethoxy-3-keto-valeronitrile Formula: C13H13ClFNO2 MolecularWeight: 269.699223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13ClFNO2/c1-2-18-7-6-12(17)9(8-16)13-10(14)4-3-5-11(13)15/h3-5,9H,2,6-7H2,1H3