cyanomethyl 5-(diethylsulfamoyl)-2-fluoranyl-benzoate

Systemtic Name: cyanomethyl 5-(diethylsulfamoyl)-2-fluoranyl-benzoate Openeye Name: cyanomethyl 5-(diethylsulfamoyl)-2-fluoro-benzoate CAS Name: 5-(diethylsulfamoyl)-2-fluorobenzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 5-(diethylsulfamoyl)-2-fluorobenzoate Traditional Name: 5-(diethylsulfamoyl)-2-fluoro-benzoic acid cyanomethyl ester Formula: C13H15FN2O4S MolecularWeight: 314.332603

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)F)C(=O)OCC#N

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)F)C(=O)OCC#N

InChI

InChI=1S/C13H15FN2O4S/c1-3-16(4-2)21(18,19)10-5-6-12(14)11(9-10)13(17)20-8-7-15/h5-6,9H,3-4,8H2,1-2H3