3-(2-diethylaminoethylsulfamoyl)-4-fluoranyl-benzoic acid

Systemtic Name: 3-(2-diethylaminoethylsulfamoyl)-4-fluoranyl-benzoic acid Openeye Name: 3-(2-diethylaminoethylsulfamoyl)-4-fluoro-benzoic acid CAS Name: 3-(2-diethylaminoethylsulfamoyl)-4-fluorobenzoic acid IUPAC Name: 3-(2-diethylaminoethylsulfamoyl)-4-fluorobenzoic acid Traditional Name: 3-(2-diethylaminoethylsulfamoyl)-4-fluoro-benzoic acid Formula: C13H19FN2O4S MolecularWeight: 318.364363

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)F

Isomeric SMILES

CCN(CC)CCNS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)F

InChI

InChI=1S/C13H19FN2O4S/c1-3-16(4-2)8-7-15-21(19,20)12-9-10(13(17)18)5-6-11(12)14/h5-6,9,15H,3-4,7-8H2,1-2H3,(H,17,18)