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

Systemtic Name: 3-[2-cyanoethyl(methyl)sulfamoyl]-4-fluoranyl-benzoic acid Openeye Name: 3-[2-cyanoethyl(methyl)sulfamoyl]-4-fluoro-benzoic acid CAS Name: 3-[2-cyanoethyl(methyl)sulfamoyl]-4-fluorobenzoic acid IUPAC Name: 3-[2-cyanoethyl(methyl)sulfamoyl]-4-fluorobenzoic acid Traditional Name: 3-[2-cyanoethyl(methyl)sulfamoyl]-4-fluoro-benzoic acid Formula: C11H11FN2O4S MolecularWeight: 286.279443

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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)