5-bromanyl-2-fluoranyl-3-[2-(methylamino)-2-oxidanylidene-ethyl]sulfonyl-benzoic acid

Systemtic Name: 5-bromanyl-2-fluoranyl-3-[2-(methylamino)-2-oxidanylidene-ethyl]sulfonyl-benzoic acid Openeye Name: 5-bromo-2-fluoro-3-[2-(methylamino)-2-oxo-ethyl]sulfonyl-benzoic acid CAS Name: 5-bromo-2-fluoro-3-[2-(methylamino)-2-oxoethyl]sulfonylbenzoic acid IUPAC Name: 5-bromo-2-fluoro-3-[2-(methylamino)-2-oxoethyl]sulfonylbenzoic acid Traditional Name: 5-bromo-2-fluoro-3-[2-keto-2-(methylamino)ethyl]sulfonyl-benzoic acid Formula: C10H9BrFNO5S MolecularWeight: 354.149563

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CS(=O)(=O)C1=C(C(=CC(=C1)Br)C(=O)O)F

Isomeric SMILES

CNC(=O)CS(=O)(=O)C1=C(C(=CC(=C1)Br)C(=O)O)F

InChI

InChI=1S/C10H9BrFNO5S/c1-13-8(14)4-19(17,18)7-3-5(11)2-6(9(7)12)10(15)16/h2-3H,4H2,1H3,(H,13,14)(H,15,16)