4-[[(5-bromanylfuran-2-yl)carbonylamino]methyl]benzenesulfonic acid

Systemtic Name: 4-[[(5-bromanylfuran-2-yl)carbonylamino]methyl]benzenesulfonic acid Openeye Name: 4-[[(5-bromofuran-2-carbonyl)amino]methyl]benzenesulfonic acid CAS Name: 4-[[[(5-bromo-2-furanyl)-oxomethyl]amino]methyl]benzenesulfonic acid IUPAC Name: 4-[[(5-bromofuran-2-carbonyl)amino]methyl]benzenesulfonic acid Traditional Name: 4-[[(5-bromo-2-furoyl)amino]methyl]besylic acid Formula: C12H10BrNO5S MolecularWeight: 360.1805

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CC=C(O2)Br)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CC=C(O2)Br)S(=O)(=O)O

InChI

InChI=1S/C12H10BrNO5S/c13-11-6-5-10(19-11)12(15)14-7-8-1-3-9(4-2-8)20(16,17)18/h1-6H,7H2,(H,14,15)(H,16,17,18)