2-(hydroxymethyl)-5-thiophen-2-yl-1-[4-(trifluoromethyl)phenyl]carbonyl-pyrrolidine-2,4-dicarboxylic acid

Systemtic Name: 2-(hydroxymethyl)-5-thiophen-2-yl-1-[4-(trifluoromethyl)phenyl]carbonyl-pyrrolidine-2,4-dicarboxylic acid Openeye Name: 2-(hydroxymethyl)-5-(2-thienyl)-1-[4-(trifluoromethyl)benzoyl]pyrrolidine-2,4-dicarboxylic acid CAS Name: 2-(hydroxymethyl)-1-[oxo-[4-(trifluoromethyl)phenyl]methyl]-5-thiophen-2-ylpyrrolidine-2,4-dicarboxylic acid IUPAC Name: 2-(hydroxymethyl)-5-thiophen-2-yl-1-[4-(trifluoromethyl)benzoyl]pyrrolidine-2,4-dicarboxylic acid Traditional Name: 2-methylol-5-(2-thienyl)-1-[4-(trifluoromethyl)benzoyl]pyrrolidine-2,4-dicarboxylic acid Formula: C19H16F3NO6S MolecularWeight: 443.39365

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(N(C1(CO)C(=O)O)C(=O)C2=CC=C(C=C2)C(F)(F)F)C3=CC=CS3)C(=O)O

Isomeric SMILES

C1C(C(N(C1(CO)C(=O)O)C(=O)C2=CC=C(C=C2)C(F)(F)F)C3=CC=CS3)C(=O)O

InChI

InChI=1S/C19H16F3NO6S/c20-19(21,22)11-5-3-10(4-6-11)15(25)23-14(13-2-1-7-30-13)12(16(26)27)8-18(23,9-24)17(28)29/h1-7,12,14,24H,8-9H2,(H,26,27)(H,28,29)