methyl 3,3,3-tris(fluoranyl)-2-[(4-methylphenyl)sulfonylamino]-2-oxidanyl-propanoate

Systemtic Name: methyl 3,3,3-tris(fluoranyl)-2-[(4-methylphenyl)sulfonylamino]-2-oxidanyl-propanoate Openeye Name: methyl 3,3,3-trifluoro-2-hydroxy-2-(p-tolylsulfonylamino)propanoate CAS Name: 3,3,3-trifluoro-2-hydroxy-2-[(4-methylphenyl)sulfonylamino]propanoic acid methyl ester IUPAC Name: methyl 3,3,3-trifluoro-2-hydroxy-2-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 3,3,3-trifluoro-2-hydroxy-2-(tosylamino)propionic acid methyl ester Formula: C11H12F3NO5S MolecularWeight: 327.27689

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(=O)OC)(C(F)(F)F)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C(=O)OC)(C(F)(F)F)O

InChI

InChI=1S/C11H12F3NO5S/c1-7-3-5-8(6-4-7)21(18,19)15-10(17,9(16)20-2)11(12,13)14/h3-6,15,17H,1-2H3