benzenecarbonitrile; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: benzenecarbonitrile; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: benzonitrile; 2,2,2-trifluoroacetic acid CAS Name: benzonitrile; 2,2,2-trifluoroacetic acid IUPAC Name: benzonitrile; 2,2,2-trifluoroacetic acid Traditional Name: benzonitrile; 2,2,2-trifluoroacetic acid Formula: C9H6F3NO2 MolecularWeight: 217.14465

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H5N.C2HF3O2/c8-6-7-4-2-1-3-5-7;3-2(4,5)1(6)7/h1-5H;(H,6,7)