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

Systemtic Name: 4-(3-chlorophenyl)carbonyl-1-cyclopropylcarbonyl-2-methyl-5-(3-nitrophenyl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 4-(3-chlorobenzoyl)-1-(cyclopropanecarbonyl)-2-methyl-5-(3-nitrophenyl)-3-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 4-[(3-chlorophenyl)-oxomethyl]-1-[cyclopropyl(oxo)methyl]-2-methyl-5-(3-nitrophenyl)-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(3-chlorobenzoyl)-1-(cyclopropanecarbonyl)-2-methyl-5-(3-nitrophenyl)-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 4-(3-chlorobenzoyl)-1-(cyclopropanecarbonyl)-2-methyl-5-(3-nitrophenyl)-3-(2-thienyl)proline Formula: C27H23ClN2O6S MolecularWeight: 538.99932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C(N1C(=O)C2CC2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C4=CC(=CC=C4)Cl)C5=CC=CS5)C(=O)O

Isomeric SMILES

CC1(C(C(C(N1C(=O)C2CC2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C4=CC(=CC=C4)Cl)C5=CC=CS5)C(=O)O

InChI

InChI=1S/C27H23ClN2O6S/c1-27(26(33)34)22(20-9-4-12-37-20)21(24(31)17-6-2-7-18(28)13-17)23(29(27)25(32)15-10-11-15)16-5-3-8-19(14-16)30(35)36/h2-9,12-15,21-23H,10-11H2,1H3,(H,33,34)