2-(3-azanyl-3-oxidanylidene-propyl)-1-(4-chlorophenyl)carbonyl-5-thiophen-2-yl-pyrrolidine-2,4-dicarboxylic acid

Systemtic Name: 2-(3-azanyl-3-oxidanylidene-propyl)-1-(4-chlorophenyl)carbonyl-5-thiophen-2-yl-pyrrolidine-2,4-dicarboxylic acid Openeye Name: 2-(3-amino-3-oxo-propyl)-1-(4-chlorobenzoyl)-5-(2-thienyl)pyrrolidine-2,4-dicarboxylic acid CAS Name: 2-(3-amino-3-oxopropyl)-1-[(4-chlorophenyl)-oxomethyl]-5-thiophen-2-ylpyrrolidine-2,4-dicarboxylic acid IUPAC Name: 2-(3-amino-3-oxopropyl)-1-(4-chlorobenzoyl)-5-thiophen-2-ylpyrrolidine-2,4-dicarboxylic acid Traditional Name: 2-(3-amino-3-keto-propyl)-1-(4-chlorobenzoyl)-5-(2-thienyl)pyrrolidine-2,4-dicarboxylic acid Formula: C20H19ClN2O6S MolecularWeight: 450.89266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(N(C1(CCC(=O)N)C(=O)O)C(=O)C2=CC=C(C=C2)Cl)C3=CC=CS3)C(=O)O

Isomeric SMILES

C1C(C(N(C1(CCC(=O)N)C(=O)O)C(=O)C2=CC=C(C=C2)Cl)C3=CC=CS3)C(=O)O

InChI

InChI=1S/C20H19ClN2O6S/c21-12-5-3-11(4-6-12)17(25)23-16(14-2-1-9-30-14)13(18(26)27)10-20(23,19(28)29)8-7-15(22)24/h1-6,9,13,16H,7-8,10H2,(H2,22,24)(H,26,27)(H,28,29)