4-(3-chlorophenyl)carbonyl-1-(2-methoxyethanoyl)-5-(3-nitrophenyl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid

Systemtic Name: 4-(3-chlorophenyl)carbonyl-1-(2-methoxyethanoyl)-5-(3-nitrophenyl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 4-(3-chlorobenzoyl)-1-(2-methoxyacetyl)-5-(3-nitrophenyl)-3-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 4-[(3-chlorophenyl)-oxomethyl]-1-(2-methoxy-1-oxoethyl)-5-(3-nitrophenyl)-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(3-chlorobenzoyl)-1-(2-methoxyacetyl)-5-(3-nitrophenyl)-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 4-(3-chlorobenzoyl)-1-(2-methoxyacetyl)-5-(3-nitrophenyl)-3-(2-thienyl)proline Formula: C25H21ClN2O7S MolecularWeight: 528.96144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1C(C(C(C1C(=O)O)C2=CC=CS2)C(=O)C3=CC(=CC=C3)Cl)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COCC(=O)N1C(C(C(C1C(=O)O)C2=CC=CS2)C(=O)C3=CC(=CC=C3)Cl)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H21ClN2O7S/c1-35-13-19(29)27-22(14-5-3-8-17(12-14)28(33)34)21(24(30)15-6-2-7-16(26)11-15)20(23(27)25(31)32)18-9-4-10-36-18/h2-12,20-23H,13H2,1H3,(H,31,32)