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

Systemtic Name: 3-methyl-2-phenoxy-4-[[4-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid Openeye Name: 3-methyl-2-phenoxy-4-[[4-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid CAS Name: 3-methyl-2-phenoxy-4-[[4-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid IUPAC Name: 3-methyl-2-phenoxy-4-[[4-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid Traditional Name: 3-methyl-2-phenoxy-4-[[4-(trifluoromethyl)phenyl]sulfonylamino]butyric acid Formula: C18H18F3NO5S MolecularWeight: 417.39943

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNS(=O)(=O)C1=CC=C(C=C1)C(F)(F)F)C(C(=O)O)OC2=CC=CC=C2

Isomeric SMILES

CC(CNS(=O)(=O)C1=CC=C(C=C1)C(F)(F)F)C(C(=O)O)OC2=CC=CC=C2

InChI

InChI=1S/C18H18F3NO5S/c1-12(16(17(23)24)27-14-5-3-2-4-6-14)11-22-28(25,26)15-9-7-13(8-10-15)18(19,20)21/h2-10,12,16,22H,11H2,1H3,(H,23,24)