3-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]thiophene-2-carboxylic acid

Systemtic Name: 3-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]thiophene-2-carboxylic acid Openeye Name: 3-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]thiophene-2-carboxylic acid CAS Name: 3-[[2-(4-bromo-2-fluorophenoxy)-1-oxoethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 3-[[2-(4-bromo-2-fluorophenoxy)acetyl]amino]thiophene-2-carboxylic acid Traditional Name: 3-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]-2-thenoic acid Formula: C13H9BrFNO4S MolecularWeight: 374.182263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)F)OCC(=O)NC2=C(SC=C2)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1Br)F)OCC(=O)NC2=C(SC=C2)C(=O)O

InChI

InChI=1S/C13H9BrFNO4S/c14-7-1-2-10(8(15)5-7)20-6-11(17)16-9-3-4-21-12(9)13(18)19/h1-5H,6H2,(H,16,17)(H,18,19)