3-[2-cyanoethyl(methyl)sulfamoyl]-4-fluoranyl-benzoate

Systemtic Name: 3-[2-cyanoethyl(methyl)sulfamoyl]-4-fluoranyl-benzoate Openeye Name: 3-[2-cyanoethyl(methyl)sulfamoyl]-4-fluoro-benzoate CAS Name: 3-[2-cyanoethyl(methyl)sulfamoyl]-4-fluorobenzoate IUPAC Name: 3-[2-cyanoethyl(methyl)sulfamoyl]-4-fluorobenzoate Traditional Name: 3-[2-cyanoethyl(methyl)sulfamoyl]-4-fluoro-benzoate Formula: C11H10FN2O4S- MolecularWeight: 285.271503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)S(=O)(=O)C1=C(C=CC(=C1)C(=O)[O-])F

Isomeric SMILES

CN(CCC#N)S(=O)(=O)C1=C(C=CC(=C1)C(=O)[O-])F

InChI

InChI=1S/C11H11FN2O4S/c1-14(6-2-5-13)19(17,18)10-7-8(11(15)16)3-4-9(10)12/h3-4,7H,2,6H2,1H3,(H,15,16)/p-1