[1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl] 2-fluoranyl-5-sulfamoyl-benzoate

Systemtic Name: [1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl] 2-fluoranyl-5-sulfamoyl-benzoate Openeye Name: [2-(isopropylamino)-1-methyl-2-oxo-ethyl] 2-fluoro-5-sulfamoyl-benzoate CAS Name: 2-fluoro-5-sulfamoylbenzoic acid [1-oxo-1-(propan-2-ylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(propan-2-ylamino)propan-2-yl] 2-fluoro-5-sulfamoylbenzoate Traditional Name: 2-fluoro-5-sulfamoyl-benzoic acid [2-(isopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C13H17FN2O5S MolecularWeight: 332.347883

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(C)OC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)F

Isomeric SMILES

CC(C)NC(=O)C(C)OC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)F

InChI

InChI=1S/C13H17FN2O5S/c1-7(2)16-12(17)8(3)21-13(18)10-6-9(22(15,19)20)4-5-11(10)14/h4-8H,1-3H3,(H,16,17)(H2,15,19,20)