2-[2,4,6-tris(trifluoromethylsulfonyl)phenyl]ethanoic acid

Systemtic Name: 2-[2,4,6-tris(trifluoromethylsulfonyl)phenyl]ethanoic acid Openeye Name: 2-[2,4,6-tris(trifluoromethylsulfonyl)phenyl]acetic acid CAS Name: 2-[2,4,6-tris(trifluoromethylsulfonyl)phenyl]acetic acid IUPAC Name: 2-[2,4,6-tris(trifluoromethylsulfonyl)phenyl]acetic acid Traditional Name: 2-(2,4,6-tritriflylphenyl)acetic acid Formula: C11H5F9O8S3 MolecularWeight: 532.333229

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1S(=O)(=O)C(F)(F)F)CC(=O)O)S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F

Isomeric SMILES

C1=C(C=C(C(=C1S(=O)(=O)C(F)(F)F)CC(=O)O)S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C11H5F9O8S3/c12-9(13,14)29(23,24)4-1-6(30(25,26)10(15,16)17)5(3-8(21)22)7(2-4)31(27,28)11(18,19)20/h1-2H,3H2,(H,21,22)