2-(4-bromophenyl)-2-cyano-2-fluoranyl-ethanoic acid

Systemtic Name: 2-(4-bromophenyl)-2-cyano-2-fluoranyl-ethanoic acid Openeye Name: 2-(4-bromophenyl)-2-cyano-2-fluoro-acetic acid CAS Name: 2-(4-bromophenyl)-2-cyano-2-fluoroacetic acid IUPAC Name: 2-(4-bromophenyl)-2-cyano-2-fluoroacetic acid Traditional Name: 2-(4-bromophenyl)-2-cyano-2-fluoro-acetic acid Formula: C9H5BrFNO2 MolecularWeight: 258.043903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C#N)(C(=O)O)F)Br

Isomeric SMILES

C1=CC(=CC=C1C(C#N)(C(=O)O)F)Br

InChI

InChI=1S/C9H5BrFNO2/c10-7-3-1-6(2-4-7)9(11,5-12)8(13)14/h1-4H,(H,13,14)