2-(5-fluoranyl-2-nitro-phenyl)ethanenitrile

Systemtic Name: 2-(5-fluoranyl-2-nitro-phenyl)ethanenitrile Openeye Name: 2-(5-fluoro-2-nitro-phenyl)acetonitrile CAS Name: 2-(5-fluoro-2-nitrophenyl)acetonitrile IUPAC Name: 2-(5-fluoro-2-nitrophenyl)acetonitrile Traditional Name: 2-(5-fluoro-2-nitro-phenyl)acetonitrile Formula: C8H5FN2O2 MolecularWeight: 180.135903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)CC#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1F)CC#N)[N+](=O)[O-]

InChI

InChI=1S/C8H5FN2O2/c9-7-1-2-8(11(12)13)6(5-7)3-4-10/h1-2,5H,3H2