sodium 5-bromanyl-2,4-dimethyl-benzenesulfinate

Systemtic Name: sodium 5-bromanyl-2,4-dimethyl-benzenesulfinate Openeye Name: sodium 5-bromo-2,4-dimethyl-benzenesulfinate CAS Name: sodium 5-bromo-2,4-dimethylbenzenesulfinate IUPAC Name: sodium 5-bromo-2,4-dimethylbenzenesulfinate Traditional Name: sodium 5-bromo-2,4-dimethyl-benzenesulfinate Formula: C8H8BrNaO2S MolecularWeight: 271.10669

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1S(=O)[O-])Br)C.[Na+]

Isomeric SMILES

CC1=CC(=C(C=C1S(=O)[O-])Br)C.[Na+]

InChI

InChI=1S/C8H9BrO2S.Na/c1-5-3-6(2)8(12(10)11)4-7(5)9;/h3-4H,1-2H3,(H,10,11);/q;+1/p-1