2-[[4-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]phenyl]sulfonylamino]ethanoic acid

Systemtic Name: 2-[[4-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[4-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]phenyl]sulfonylamino]acetic acid CAS Name: 2-[[4-[[2-(4-bromo-2-fluorophenoxy)-1-oxoethyl]amino]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[4-[[2-(4-bromo-2-fluorophenoxy)acetyl]amino]phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[4-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]phenyl]sulfonylamino]acetic acid Formula: C16H14BrFN2O6S MolecularWeight: 461.259563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)COC2=C(C=C(C=C2)Br)F)S(=O)(=O)NCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1NC(=O)COC2=C(C=C(C=C2)Br)F)S(=O)(=O)NCC(=O)O

InChI

InChI=1S/C16H14BrFN2O6S/c17-10-1-6-14(13(18)7-10)26-9-15(21)20-11-2-4-12(5-3-11)27(24,25)19-8-16(22)23/h1-7,19H,8-9H2,(H,20,21)(H,22,23)