3-[2-(4-bromanylphenoxy)ethanoylamino]thiophene-2-carboxylic acid

Systemtic Name: 3-[2-(4-bromanylphenoxy)ethanoylamino]thiophene-2-carboxylic acid Openeye Name: 3-[[2-(4-bromophenoxy)acetyl]amino]thiophene-2-carboxylic acid CAS Name: 3-[[2-(4-bromophenoxy)-1-oxoethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 3-[[2-(4-bromophenoxy)acetyl]amino]thiophene-2-carboxylic acid Traditional Name: 3-[[2-(4-bromophenoxy)acetyl]amino]-2-thenoic acid Formula: C13H10BrNO4S MolecularWeight: 356.1918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCC(=O)NC2=C(SC=C2)C(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1OCC(=O)NC2=C(SC=C2)C(=O)O)Br

InChI

InChI=1S/C13H10BrNO4S/c14-8-1-3-9(4-2-8)19-7-11(16)15-10-5-6-20-12(10)13(17)18/h1-6H,7H2,(H,15,16)(H,17,18)