2-[4,5-bis(fluoranyl)-2-oxidanyl-phenyl]ethanenitrile

Systemtic Name: 2-[4,5-bis(fluoranyl)-2-oxidanyl-phenyl]ethanenitrile Openeye Name: 2-(4,5-difluoro-2-hydroxy-phenyl)acetonitrile CAS Name: 2-(4,5-difluoro-2-hydroxyphenyl)acetonitrile IUPAC Name: 2-(4,5-difluoro-2-hydroxyphenyl)acetonitrile Traditional Name: 2-(4,5-difluoro-2-hydroxy-phenyl)acetonitrile Formula: C8H5F2NO MolecularWeight: 169.128206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1F)F)O)CC#N

Isomeric SMILES

C1=C(C(=CC(=C1F)F)O)CC#N

InChI

InChI=1S/C8H5F2NO/c9-6-3-5(1-2-11)8(12)4-7(6)10/h3-4,12H,1H2