(3-cyanophenyl) 4-chloranyl-2-(trifluoromethyl)benzenesulfonate

Systemtic Name: (3-cyanophenyl) 4-chloranyl-2-(trifluoromethyl)benzenesulfonate Openeye Name: (3-cyanophenyl) 4-chloro-2-(trifluoromethyl)benzenesulfonate CAS Name: 4-chloro-2-(trifluoromethyl)benzenesulfonic acid (3-cyanophenyl) ester IUPAC Name: (3-cyanophenyl) 4-chloro-2-(trifluoromethyl)benzenesulfonate Traditional Name: 4-chloro-2-(trifluoromethyl)benzenesulfonic acid (3-cyanophenyl) ester Formula: C14H7ClF3NO3S MolecularWeight: 361.72349

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H7ClF3NO3S/c15-10-4-5-13(12(7-10)14(16,17)18)23(20,21)22-11-3-1-2-9(6-11)8-19/h1-7H