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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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