sodium 3-bromanyl-1-(4-oxidanidylperoxysulfanylphenyl)propan-1-one

Systemtic Name: sodium 3-bromanyl-1-(4-oxidanidylperoxysulfanylphenyl)propan-1-one Openeye Name: sodium 3-bromo-1-(4-oxidoperoxysulfanylphenyl)propan-1-one CAS Name: sodium 4-(3-bromo-1-oxopropyl)benzenesulfenic acid oxidooxy ester IUPAC Name: sodium 3-bromo-1-(4-oxidoperoxysulfanylphenyl)propan-1-one Traditional Name: sodium 3-bromo-1-[4-(oxidoperoxythio)phenyl]propan-1-one Formula: C9H8BrNaO4S MolecularWeight: 315.11619

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCBr)SOO[O-].[Na+]

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCBr)SOO[O-].[Na+]

InChI

InChI=1S/C9H9BrO4S.Na/c10-6-5-9(11)7-1-3-8(4-2-7)15-14-13-12;/h1-4,12H,5-6H2;/q;+1/p-1