3-methyl-2-[[4-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid

Systemtic Name: 3-methyl-2-[[4-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid Openeye Name: 3-methyl-2-[[4-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid CAS Name: 3-methyl-2-[[4-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid IUPAC Name: 3-methyl-2-[[4-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid Traditional Name: 3-methyl-2-[[4-(trifluoromethyl)phenyl]sulfonylamino]butyric acid Formula: C12H14F3NO4S MolecularWeight: 325.30407

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C(F)(F)F

Isomeric SMILES

CC(C)C(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C12H14F3NO4S/c1-7(2)10(11(17)18)16-21(19,20)9-5-3-8(4-6-9)12(13,14)15/h3-7,10,16H,1-2H3,(H,17,18)