2-(5-bromanyl-2-fluoranyl-phenyl)-3,5-bis(fluoranyl)benzenecarbonitrile

Systemtic Name: 2-(5-bromanyl-2-fluoranyl-phenyl)-3,5-bis(fluoranyl)benzenecarbonitrile Openeye Name: 2-(5-bromo-2-fluoro-phenyl)-3,5-difluoro-benzonitrile CAS Name: 2-(5-bromo-2-fluorophenyl)-3,5-difluorobenzonitrile IUPAC Name: 2-(5-bromo-2-fluorophenyl)-3,5-difluorobenzonitrile Traditional Name: 2-(5-bromo-2-fluoro-phenyl)-3,5-difluoro-benzonitrile Formula: C13H5BrF3N MolecularWeight: 312.08471

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C2=C(C=C(C=C2C#N)F)F)F

Isomeric SMILES

C1=CC(=C(C=C1Br)C2=C(C=C(C=C2C#N)F)F)F

InChI

InChI=1S/C13H5BrF3N/c14-8-1-2-11(16)10(4-8)13-7(6-18)3-9(15)5-12(13)17/h1-5H