(2-fluorophenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate

Systemtic Name: (2-fluorophenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate Openeye Name: (2-fluorophenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate CAS Name: 4-(2-cyanoethylsulfamoyl)benzoic acid (2-fluorophenyl)methyl ester IUPAC Name: (2-fluorophenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate Traditional Name: 4-(2-cyanoethylsulfamoyl)benzoic acid (2-fluorobenzyl) ester Formula: C17H15FN2O4S MolecularWeight: 362.375403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC#N)F

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC#N)F

InChI

InChI=1S/C17H15FN2O4S/c18-16-5-2-1-4-14(16)12-24-17(21)13-6-8-15(9-7-13)25(22,23)20-11-3-10-19/h1-2,4-9,20H,3,11-12H2