[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 2-fluoranyl-5-sulfamoyl-benzoate

Systemtic Name: [2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 2-fluoranyl-5-sulfamoyl-benzoate Openeye Name: [2-(5-bromo-2-thienyl)-2-oxo-ethyl] 2-fluoro-5-sulfamoyl-benzoate CAS Name: 2-fluoro-5-sulfamoylbenzoic acid [2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-bromothiophen-2-yl)-2-oxoethyl] 2-fluoro-5-sulfamoylbenzoate Traditional Name: 2-fluoro-5-sulfamoyl-benzoic acid [2-(5-bromo-2-thienyl)-2-keto-ethyl] ester Formula: C13H9BrFNO5S2 MolecularWeight: 422.246663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)N)C(=O)OCC(=O)C2=CC=C(S2)Br)F

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)N)C(=O)OCC(=O)C2=CC=C(S2)Br)F

InChI

InChI=1S/C13H9BrFNO5S2/c14-12-4-3-11(22-12)10(17)6-21-13(18)8-5-7(23(16,19)20)1-2-9(8)15/h1-5H,6H2,(H2,16,19,20)