(3-cyanophenyl) 4-bromanylbenzenesulfonate

Systemtic Name: (3-cyanophenyl) 4-bromanylbenzenesulfonate Openeye Name: (3-cyanophenyl) 4-bromobenzenesulfonate CAS Name: 4-bromobenzenesulfonic acid (3-cyanophenyl) ester IUPAC Name: (3-cyanophenyl) 4-bromobenzenesulfonate Traditional Name: 4-bromobenzenesulfonic acid (3-cyanophenyl) ester Formula: C13H8BrNO3S MolecularWeight: 338.17652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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