[4-(trifluoromethyl)phenyl]methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate

Systemtic Name: [4-(trifluoromethyl)phenyl]methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate Openeye Name: [4-(trifluoromethyl)phenyl]methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate CAS Name: 3-[(4-acetamidophenyl)sulfonylamino]propanoic acid [4-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [4-(trifluoromethyl)phenyl]methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-acetamidophenyl)sulfonylamino]propionic acid [4-(trifluoromethyl)benzyl] ester Formula: C19H19F3N2O5S MolecularWeight: 444.42477

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C19H19F3N2O5S/c1-13(25)24-16-6-8-17(9-7-16)30(27,28)23-11-10-18(26)29-12-14-2-4-15(5-3-14)19(20,21)22/h2-9,23H,10-12H2,1H3,(H,24,25)