1-bromanyl-4-(2-sulfosulfanylethanoyl)benzene

Systemtic Name: 1-bromanyl-4-(2-sulfosulfanylethanoyl)benzene Openeye Name: 1-bromo-4-(2-sulfosulfanylacetyl)benzene CAS Name: 1-bromo-4-[1-oxo-2-(sulfothio)ethyl]benzene IUPAC Name: 1-bromo-4-(2-sulfosulfanylacetyl)benzene Traditional Name: 1-bromo-4-[2-(sulfothio)acetyl]benzene Formula: C8H7BrO4S2 MolecularWeight: 311.17278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CSS(=O)(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)CSS(=O)(=O)O)Br

InChI

InChI=1S/C8H7BrO4S2/c9-7-3-1-6(2-4-7)8(10)5-14-15(11,12)13/h1-4H,5H2,(H,11,12,13)