2-fluoranyl-6-(3-methylsulfonylpropanoylamino)benzoic acid

Systemtic Name: 2-fluoranyl-6-(3-methylsulfonylpropanoylamino)benzoic acid Openeye Name: 2-fluoro-6-(3-methylsulfonylpropanoylamino)benzoic acid CAS Name: 2-fluoro-6-[(3-methylsulfonyl-1-oxopropyl)amino]benzoic acid IUPAC Name: 2-fluoro-6-(3-methylsulfonylpropanoylamino)benzoic acid Traditional Name: 2-fluoro-6-(3-mesylpropanoylamino)benzoic acid Formula: C11H12FNO5S MolecularWeight: 289.280083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(=O)NC1=C(C(=CC=C1)F)C(=O)O

Isomeric SMILES

CS(=O)(=O)CCC(=O)NC1=C(C(=CC=C1)F)C(=O)O

InChI

InChI=1S/C11H12FNO5S/c1-19(17,18)6-5-9(14)13-8-4-2-3-7(12)10(8)11(15)16/h2-4H,5-6H2,1H3,(H,13,14)(H,15,16)