(2-chloranyl-4-cyano-phenyl) 2-chloranyl-4-fluoranyl-benzenesulfonate

Systemtic Name: (2-chloranyl-4-cyano-phenyl) 2-chloranyl-4-fluoranyl-benzenesulfonate Openeye Name: (2-chloro-4-cyano-phenyl) 2-chloro-4-fluoro-benzenesulfonate CAS Name: 2-chloro-4-fluorobenzenesulfonic acid (2-chloro-4-cyanophenyl) ester IUPAC Name: (2-chloro-4-cyanophenyl) 2-chloro-4-fluorobenzenesulfonate Traditional Name: 2-chloro-4-fluoro-benzenesulfonic acid (2-chloro-4-cyano-phenyl) ester Formula: C13H6Cl2FNO3S MolecularWeight: 346.161043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H6Cl2FNO3S/c14-10-5-8(7-17)1-3-12(10)20-21(18,19)13-4-2-9(16)6-11(13)15/h1-6H