(2-cyanophenyl) 3-bromanylbenzenesulfonate

Systemtic Name: (2-cyanophenyl) 3-bromanylbenzenesulfonate Openeye Name: (2-cyanophenyl) 3-bromobenzenesulfonate CAS Name: 3-bromobenzenesulfonic acid (2-cyanophenyl) ester IUPAC Name: (2-cyanophenyl) 3-bromobenzenesulfonate Traditional Name: 3-bromobenzenesulfonic acid (2-cyanophenyl) ester Formula: C13H8BrNO3S MolecularWeight: 338.17652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)OS(=O)(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

C1=CC=C(C(=C1)C#N)OS(=O)(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C13H8BrNO3S/c14-11-5-3-6-12(8-11)19(16,17)18-13-7-2-1-4-10(13)9-15/h1-8H