3-(2-phenylmethoxyethanoyl)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-(2-phenylmethoxyethanoyl)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-(2-benzyloxyacetyl)-2-[4-(trifluoromethyl)phenyl]thiazolidine-4-carboxylic acid CAS Name: 3-(1-oxo-2-phenylmethoxyethyl)-2-[4-(trifluoromethyl)phenyl]-4-thiazolidinecarboxylic acid IUPAC Name: 3-(2-phenylmethoxyacetyl)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-(2-benzoxyacetyl)-2-[4-(trifluoromethyl)phenyl]thiazolidine-4-carboxylic acid Formula: C20H18F3NO4S MolecularWeight: 425.42143

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C(S1)C2=CC=C(C=C2)C(F)(F)F)C(=O)COCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1C(N(C(S1)C2=CC=C(C=C2)C(F)(F)F)C(=O)COCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H18F3NO4S/c21-20(22,23)15-8-6-14(7-9-15)18-24(16(12-29-18)19(26)27)17(25)11-28-10-13-4-2-1-3-5-13/h1-9,16,18H,10-12H2,(H,26,27)