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

Systemtic Name: (2-cyanophenyl) 3-chloranyl-4-fluoranyl-benzenesulfonate Openeye Name: (2-cyanophenyl) 3-chloro-4-fluoro-benzenesulfonate CAS Name: 3-chloro-4-fluorobenzenesulfonic acid (2-cyanophenyl) ester IUPAC Name: (2-cyanophenyl) 3-chloro-4-fluorobenzenesulfonate Traditional Name: 3-chloro-4-fluoro-benzenesulfonic acid (2-cyanophenyl) ester Formula: C13H7ClFNO3S MolecularWeight: 311.715983

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H7ClFNO3S/c14-11-7-10(5-6-12(11)15)20(17,18)19-13-4-2-1-3-9(13)8-16/h1-7H