3-(4-chlorophenyl)-1-cyclohexylcarbonyl-2-methyl-5-(3-nitrophenyl)-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 3-(4-chlorophenyl)-1-cyclohexylcarbonyl-2-methyl-5-(3-nitrophenyl)-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 3-(4-chlorophenyl)-1-(cyclohexanecarbonyl)-2-methyl-5-(3-nitrophenyl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 3-(4-chlorophenyl)-1-[cyclohexyl(oxo)methyl]-2-methyl-5-(3-nitrophenyl)-4-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 3-(4-chlorophenyl)-1-(cyclohexanecarbonyl)-2-methyl-5-(3-nitrophenyl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 3-(4-chlorophenyl)-1-(cyclohexanecarbonyl)-2-methyl-5-(3-nitrophenyl)-4-(2-thenoyl)proline Formula: C30H29ClN2O6S MolecularWeight: 581.07906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C(N1C(=O)C2CCCCC2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C4=CC=CS4)C5=CC=C(C=C5)Cl)C(=O)O

Isomeric SMILES

CC1(C(C(C(N1C(=O)C2CCCCC2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C4=CC=CS4)C5=CC=C(C=C5)Cl)C(=O)O

InChI

InChI=1S/C30H29ClN2O6S/c1-30(29(36)37)25(18-12-14-21(31)15-13-18)24(27(34)23-11-6-16-40-23)26(20-9-5-10-22(17-20)33(38)39)32(30)28(35)19-7-3-2-4-8-19/h5-6,9-17,19,24-26H,2-4,7-8H2,1H3,(H,36,37)