sodium 4-(2-bromoethyl)benzenesulfonate

Systemtic Name: sodium 4-(2-bromoethyl)benzenesulfonate Openeye Name: sodium 4-(2-bromoethyl)benzenesulfonate CAS Name: sodium 4-(2-bromoethyl)benzenesulfonate IUPAC Name: sodium 4-(2-bromoethyl)benzenesulfonate Traditional Name: sodium 4-(2-bromoethyl)besylate Formula: C8H8BrNaO3S MolecularWeight: 287.10609

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCBr)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC(=CC=C1CCBr)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C8H9BrO3S.Na/c9-6-5-7-1-3-8(4-2-7)13(10,11)12;/h1-4H,5-6H2,(H,10,11,12);/q;+1/p-1