2-[4-[2-[(4-bromophenyl)sulfonylamino]ethylsulfanyl]phenoxy]-2-fluoranyl-ethanoic acid

Systemtic Name: 2-[4-[2-[(4-bromophenyl)sulfonylamino]ethylsulfanyl]phenoxy]-2-fluoranyl-ethanoic acid Openeye Name: 2-[4-[2-[(4-bromophenyl)sulfonylamino]ethylsulfanyl]phenoxy]-2-fluoro-acetic acid CAS Name: 2-[4-[2-[(4-bromophenyl)sulfonylamino]ethylthio]phenoxy]-2-fluoroacetic acid IUPAC Name: 2-[4-[2-[(4-bromophenyl)sulfonylamino]ethylsulfanyl]phenoxy]-2-fluoroacetic acid Traditional Name: 2-[4-[2-(brosylamino)ethylthio]phenoxy]-2-fluoro-acetic acid Formula: C16H15BrFNO5S2 MolecularWeight: 464.326403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC(C(=O)O)F)SCCNS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C1=CC(=CC=C1OC(C(=O)O)F)SCCNS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H15BrFNO5S2/c17-11-1-7-14(8-2-11)26(22,23)19-9-10-25-13-5-3-12(4-6-13)24-15(18)16(20)21/h1-8,15,19H,9-10H2,(H,20,21)