methyl 4-[2-[[2-(trifluoromethyl)phenyl]sulfonylamino]propanoylamino]benzoate

Systemtic Name: methyl 4-[2-[[2-(trifluoromethyl)phenyl]sulfonylamino]propanoylamino]benzoate Openeye Name: methyl 4-[2-[[2-(trifluoromethyl)phenyl]sulfonylamino]propanoylamino]benzoate CAS Name: 4-[[1-oxo-2-[[2-(trifluoromethyl)phenyl]sulfonylamino]propyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[2-(trifluoromethyl)phenyl]sulfonylamino]propanoylamino]benzoate Traditional Name: 4-[2-[[2-(trifluoromethyl)phenyl]sulfonylamino]propanoylamino]benzoic acid methyl ester Formula: C18H17F3N2O5S MolecularWeight: 430.39819

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)OC)NS(=O)(=O)C2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)OC)NS(=O)(=O)C2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C18H17F3N2O5S/c1-11(16(24)22-13-9-7-12(8-10-13)17(25)28-2)23-29(26,27)15-6-4-3-5-14(15)18(19,20)21/h3-11,23H,1-2H3,(H,22,24)