methyl 2-(phenylsulfonylamino)-3-[4-(trifluoromethylsulfonyloxy)phenyl]propanoate

Systemtic Name: methyl 2-(phenylsulfonylamino)-3-[4-(trifluoromethylsulfonyloxy)phenyl]propanoate Openeye Name: methyl 2-(benzenesulfonamido)-3-[4-(trifluoromethylsulfonyloxy)phenyl]propanoate CAS Name: 2-(benzenesulfonamido)-3-[4-(trifluoromethylsulfonyloxy)phenyl]propanoic acid methyl ester IUPAC Name: methyl 2-(benzenesulfonamido)-3-[4-(trifluoromethylsulfonyloxy)phenyl]propanoate Traditional Name: 2-(benzenesulfonamido)-3-(4-triflyloxyphenyl)propionic acid methyl ester Formula: C17H16F3NO7S2 MolecularWeight: 467.43665

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C(CC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H16F3NO7S2/c1-27-16(22)15(21-29(23,24)14-5-3-2-4-6-14)11-12-7-9-13(10-8-12)28-30(25,26)17(18,19)20/h2-10,15,21H,11H2,1H3