1H-2-benzothiophen-4-one; 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: 1H-2-benzothiophen-4-one; 2,2,2-tris(fluoranyl)ethanoate Openeye Name: 1H-2-benzothiophen-4-one; 2,2,2-trifluoroacetate CAS Name: 1H-2-benzothiophen-4-one; 2,2,2-trifluoroacetate IUPAC Name: 1H-2-benzothiophen-4-one; 2,2,2-trifluoroacetate Traditional Name: 1H-isobenzothiophen-4-one; 2,2,2-trifluoroacetate Formula: C10H6F3O3S- MolecularWeight: 263.21305

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC(=O)C2=CS1.C(=O)(C(F)(F)F)[O-]

Isomeric SMILES

C1C2=CC=CC(=O)C2=CS1.C(=O)(C(F)(F)F)[O-]

InChI

InChI=1S/C8H6OS.C2HF3O2/c9-8-3-1-2-6-4-10-5-7(6)8;3-2(4,5)1(6)7/h1-3,5H,4H2;(H,6,7)/p-1