ethyl 2-cyano-3-oxidanylidene-3-[2-[[4-(trifluoromethyl)phenyl]methylsulfamoyl]phenyl]propanoate

Systemtic Name: ethyl 2-cyano-3-oxidanylidene-3-[2-[[4-(trifluoromethyl)phenyl]methylsulfamoyl]phenyl]propanoate Openeye Name: ethyl 2-cyano-3-oxo-3-[2-[[4-(trifluoromethyl)phenyl]methylsulfamoyl]phenyl]propanoate CAS Name: 2-cyano-3-oxo-3-[2-[[4-(trifluoromethyl)phenyl]methylsulfamoyl]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-3-oxo-3-[2-[[4-(trifluoromethyl)phenyl]methylsulfamoyl]phenyl]propanoate Traditional Name: 2-cyano-3-keto-3-[2-[[4-(trifluoromethyl)benzyl]sulfamoyl]phenyl]propionic acid ethyl ester Formula: C20H17F3N2O5S MolecularWeight: 454.41959

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C(=O)C1=CC=CC=C1S(=O)(=O)NCC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C(C#N)C(=O)C1=CC=CC=C1S(=O)(=O)NCC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C20H17F3N2O5S/c1-2-30-19(27)16(11-24)18(26)15-5-3-4-6-17(15)31(28,29)25-12-13-7-9-14(10-8-13)20(21,22)23/h3-10,16,25H,2,12H2,1H3