2-(2-methylpropyl)-1-(phenylcarbonyl)-5-thiophen-2-yl-pyrrolidine-2,4-dicarboxylic acid

Systemtic Name: 2-(2-methylpropyl)-1-(phenylcarbonyl)-5-thiophen-2-yl-pyrrolidine-2,4-dicarboxylic acid Openeye Name: 1-benzoyl-2-isobutyl-5-(2-thienyl)pyrrolidine-2,4-dicarboxylic acid CAS Name: 1-benzoyl-2-(2-methylpropyl)-5-thiophen-2-ylpyrrolidine-2,4-dicarboxylic acid IUPAC Name: 1-benzoyl-2-(2-methylpropyl)-5-thiophen-2-ylpyrrolidine-2,4-dicarboxylic acid Traditional Name: 1-benzoyl-2-isobutyl-5-(2-thienyl)pyrrolidine-2,4-dicarboxylic acid Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(CC(C(N1C(=O)C2=CC=CC=C2)C3=CC=CS3)C(=O)O)C(=O)O

Isomeric SMILES

CC(C)CC1(CC(C(N1C(=O)C2=CC=CC=C2)C3=CC=CS3)C(=O)O)C(=O)O

InChI

InChI=1S/C21H23NO5S/c1-13(2)11-21(20(26)27)12-15(19(24)25)17(16-9-6-10-28-16)22(21)18(23)14-7-4-3-5-8-14/h3-10,13,15,17H,11-12H2,1-2H3,(H,24,25)(H,26,27)