5-(4-chloranyl-2-fluoranyl-phenyl)cyclohexa-1,5-diene-1-carbonitrile

Systemtic Name: 5-(4-chloranyl-2-fluoranyl-phenyl)cyclohexa-1,5-diene-1-carbonitrile Openeye Name: 5-(4-chloro-2-fluoro-phenyl)cyclohexa-1,5-diene-1-carbonitrile CAS Name: 5-(4-chloro-2-fluorophenyl)-1-cyclohexa-1,5-dienecarbonitrile IUPAC Name: 5-(4-chloro-2-fluorophenyl)cyclohexa-1,5-diene-1-carbonitrile Traditional Name: 5-(4-chloro-2-fluoro-phenyl)cyclohexa-1,5-diene-1-carbonitrile Formula: C13H9ClFN MolecularWeight: 233.668663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC(=C1)C#N)C2=C(C=C(C=C2)Cl)F

Isomeric SMILES

C1CC(=CC(=C1)C#N)C2=C(C=C(C=C2)Cl)F

InChI

InChI=1S/C13H9ClFN/c14-11-4-5-12(13(15)7-11)10-3-1-2-9(6-10)8-16/h2,4-7H,1,3H2