[3-(trifluoromethyl)phenyl]methyl 4-(2-cyanoethylsulfamoyl)benzoate

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl 4-(2-cyanoethylsulfamoyl)benzoate Openeye Name: [3-(trifluoromethyl)phenyl]methyl 4-(2-cyanoethylsulfamoyl)benzoate CAS Name: 4-(2-cyanoethylsulfamoyl)benzoic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl 4-(2-cyanoethylsulfamoyl)benzoate Traditional Name: 4-(2-cyanoethylsulfamoyl)benzoic acid [3-(trifluoromethyl)benzyl] ester Formula: C18H15F3N2O4S MolecularWeight: 412.38291

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15F3N2O4S/c19-18(20,21)15-4-1-3-13(11-15)12-27-17(24)14-5-7-16(8-6-14)28(25,26)23-10-2-9-22/h1,3-8,11,23H,2,10,12H2