5-[3,3,3-tris(fluoranyl)propanoylamino]thiophene-2-carboxylic acid

Systemtic Name: 5-[3,3,3-tris(fluoranyl)propanoylamino]thiophene-2-carboxylic acid Openeye Name: 5-(3,3,3-trifluoropropanoylamino)thiophene-2-carboxylic acid CAS Name: 5-[(3,3,3-trifluoro-1-oxopropyl)amino]-2-thiophenecarboxylic acid IUPAC Name: 5-(3,3,3-trifluoropropanoylamino)thiophene-2-carboxylic acid Traditional Name: 5-(3,3,3-trifluoropropanoylamino)-2-thenoic acid Formula: C8H6F3NO3S MolecularWeight: 253.19835

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)NC(=O)CC(F)(F)F)C(=O)O

Isomeric SMILES

C1=C(SC(=C1)NC(=O)CC(F)(F)F)C(=O)O

InChI

InChI=1S/C8H6F3NO3S/c9-8(10,11)3-5(13)12-6-2-1-4(16-6)7(14)15/h1-2H,3H2,(H,12,13)(H,14,15)