(2-phenylphenyl) 4-[2,2,2-tris(fluoranyl)ethylcarbamoyl]benzenesulfonate

Systemtic Name: (2-phenylphenyl) 4-[2,2,2-tris(fluoranyl)ethylcarbamoyl]benzenesulfonate Openeye Name: (2-phenylphenyl) 4-(2,2,2-trifluoroethylcarbamoyl)benzenesulfonate CAS Name: 4-[oxo-(2,2,2-trifluoroethylamino)methyl]benzenesulfonic acid (2-phenylphenyl) ester IUPAC Name: (2-phenylphenyl) 4-(2,2,2-trifluoroethylcarbamoyl)benzenesulfonate Traditional Name: 4-(2,2,2-trifluoroethylcarbamoyl)benzenesulfonic acid (2-phenylphenyl) ester Formula: C21H16F3NO4S MolecularWeight: 435.41625

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2OS(=O)(=O)C3=CC=C(C=C3)C(=O)NCC(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2OS(=O)(=O)C3=CC=C(C=C3)C(=O)NCC(F)(F)F

InChI

InChI=1S/C21H16F3NO4S/c22-21(23,24)14-25-20(26)16-10-12-17(13-11-16)30(27,28)29-19-9-5-4-8-18(19)15-6-2-1-3-7-15/h1-13H,14H2,(H,25,26)