4-[5-bromanyl-2-(4-fluorophenyl)thiophen-3-yl]benzenesulfonic acid

Systemtic Name: 4-[5-bromanyl-2-(4-fluorophenyl)thiophen-3-yl]benzenesulfonic acid Openeye Name: 4-[5-bromo-2-(4-fluorophenyl)-3-thienyl]benzenesulfonic acid CAS Name: 4-[5-bromo-2-(4-fluorophenyl)-3-thiophenyl]benzenesulfonic acid IUPAC Name: 4-[5-bromo-2-(4-fluorophenyl)thiophen-3-yl]benzenesulfonic acid Traditional Name: 4-[5-bromo-2-(4-fluorophenyl)-3-thienyl]besylic acid Formula: C16H10BrFO3S2 MolecularWeight: 413.281203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C=C(S2)Br)C3=CC=C(C=C3)S(=O)(=O)O)F

Isomeric SMILES

C1=CC(=CC=C1C2=C(C=C(S2)Br)C3=CC=C(C=C3)S(=O)(=O)O)F

InChI

InChI=1S/C16H10BrFO3S2/c17-15-9-14(10-3-7-13(8-4-10)23(19,20)21)16(22-15)11-1-5-12(18)6-2-11/h1-9H,(H,19,20,21)