2-bromanyl-2-(4-sulfonatophenyl)ethanoate

Systemtic Name: 2-bromanyl-2-(4-sulfonatophenyl)ethanoate Openeye Name: 2-bromo-2-(4-sulfonatophenyl)acetate CAS Name: 2-bromo-2-(4-sulfonatophenyl)acetate IUPAC Name: 2-bromo-2-(4-sulfonatophenyl)acetate Traditional Name: 2-bromo-2-(4-sulfonatophenyl)acetate Formula: C8H5BrO5S-2 MolecularWeight: 293.0913

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C(=O)[O-])Br)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(C(=O)[O-])Br)S(=O)(=O)[O-]

InChI

InChI=1S/C8H7BrO5S/c9-7(8(10)11)5-1-3-6(4-2-5)15(12,13)14/h1-4,7H,(H,10,11)(H,12,13,14)/p-2