(4-cyanophenyl) 3,5-bis(trifluoromethyl)benzenesulfonate

Systemtic Name: (4-cyanophenyl) 3,5-bis(trifluoromethyl)benzenesulfonate Openeye Name: (4-cyanophenyl) 3,5-bis(trifluoromethyl)benzenesulfonate CAS Name: 3,5-bis(trifluoromethyl)benzenesulfonic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 3,5-bis(trifluoromethyl)benzenesulfonate Traditional Name: 3,5-bis(trifluoromethyl)benzenesulfonic acid (4-cyanophenyl) ester Formula: C15H7F6NO3S MolecularWeight: 395.276399

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OS(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C#N)OS(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C15H7F6NO3S/c16-14(17,18)10-5-11(15(19,20)21)7-13(6-10)26(23,24)25-12-3-1-9(8-22)2-4-12/h1-7H