5-[[1-(ethylamino)-1-oxidanylidene-propan-2-yl]sulfamoyl]-2-fluoranyl-benzoic acid

Systemtic Name: 5-[[1-(ethylamino)-1-oxidanylidene-propan-2-yl]sulfamoyl]-2-fluoranyl-benzoic acid Openeye Name: 5-[[2-(ethylamino)-1-methyl-2-oxo-ethyl]sulfamoyl]-2-fluoro-benzoic acid CAS Name: 5-[[1-(ethylamino)-1-oxopropan-2-yl]sulfamoyl]-2-fluorobenzoic acid IUPAC Name: 5-[[1-(ethylamino)-1-oxopropan-2-yl]sulfamoyl]-2-fluorobenzoic acid Traditional Name: 5-[[2-(ethylamino)-2-keto-1-methyl-ethyl]sulfamoyl]-2-fluoro-benzoic acid Formula: C12H15FN2O5S MolecularWeight: 318.321303

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NS(=O)(=O)C1=CC(=C(C=C1)F)C(=O)O

Isomeric SMILES

CCNC(=O)C(C)NS(=O)(=O)C1=CC(=C(C=C1)F)C(=O)O

InChI

InChI=1S/C12H15FN2O5S/c1-3-14-11(16)7(2)15-21(19,20)8-4-5-10(13)9(6-8)12(17)18/h4-7,15H,3H2,1-2H3,(H,14,16)(H,17,18)