4-methyl-2-[2,2,2-tris(fluoranyl)ethanoyl]benzenesulfinate

Systemtic Name: 4-methyl-2-[2,2,2-tris(fluoranyl)ethanoyl]benzenesulfinate Openeye Name: 4-methyl-2-(2,2,2-trifluoroacetyl)benzenesulfinate CAS Name: 4-methyl-2-(2,2,2-trifluoro-1-oxoethyl)benzenesulfinate IUPAC Name: 4-methyl-2-(2,2,2-trifluoroacetyl)benzenesulfinate Traditional Name: 4-methyl-2-(2,2,2-trifluoroacetyl)benzenesulfinate Formula: C9H6F3O3S- MolecularWeight: 251.20235

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)[O-])C(=O)C(F)(F)F

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)[O-])C(=O)C(F)(F)F

InChI

InChI=1S/C9H7F3O3S/c1-5-2-3-7(16(14)15)6(4-5)8(13)9(10,11)12/h2-4H,1H3,(H,14,15)/p-1