chloranylbenzene; ethanenitrile; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: chloranylbenzene; ethanenitrile; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: acetonitrile; chlorobenzene; 2,2,2-trifluoroacetic acid CAS Name: acetonitrile; chlorobenzene; 2,2,2-trifluoroacetic acid IUPAC Name: acetonitrile; chlorobenzene; 2,2,2-trifluoroacetic acid Traditional Name: acetonitrile; chlorobenzene; 2,2,2-trifluoroacetic acid Formula: C10H9ClF3NO2 MolecularWeight: 267.63217

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H5Cl.C2HF3O2.C2H3N/c7-6-4-2-1-3-5-6;3-2(4,5)1(6)7;1-2-3/h1-5H;(H,6,7);1H3