5-(4-methoxyphenyl)-2-methyl-1-(3-methylbutanoyl)-3-(4-nitrophenyl)-4-(phenylcarbonyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(4-methoxyphenyl)-2-methyl-1-(3-methylbutanoyl)-3-(4-nitrophenyl)-4-(phenylcarbonyl)pyrrolidine-2-carboxylic acid Openeye Name: 4-benzoyl-5-(4-methoxyphenyl)-2-methyl-1-(3-methylbutanoyl)-3-(4-nitrophenyl)pyrrolidine-2-carboxylic acid CAS Name: 4-benzoyl-5-(4-methoxyphenyl)-2-methyl-1-(3-methyl-1-oxobutyl)-3-(4-nitrophenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 4-benzoyl-5-(4-methoxyphenyl)-2-methyl-1-(3-methylbutanoyl)-3-(4-nitrophenyl)pyrrolidine-2-carboxylic acid Traditional Name: 4-benzoyl-1-isovaleryl-5-(4-methoxyphenyl)-2-methyl-3-(4-nitrophenyl)proline Formula: C31H32N2O7 MolecularWeight: 544.59498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1C(C(C(C1(C)C(=O)O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)CC(=O)N1C(C(C(C1(C)C(=O)O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C31H32N2O7/c1-19(2)18-25(34)32-28(21-12-16-24(40-4)17-13-21)26(29(35)22-8-6-5-7-9-22)27(31(32,3)30(36)37)20-10-14-23(15-11-20)33(38)39/h5-17,19,26-28H,18H2,1-4H3,(H,36,37)