5-(4-cyanophenyl)-2-methyl-1-(3-methylbutanoyl)-3-phenyl-4-(phenylcarbonyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(4-cyanophenyl)-2-methyl-1-(3-methylbutanoyl)-3-phenyl-4-(phenylcarbonyl)pyrrolidine-2-carboxylic acid Openeye Name: 4-benzoyl-5-(4-cyanophenyl)-2-methyl-1-(3-methylbutanoyl)-3-phenyl-pyrrolidine-2-carboxylic acid CAS Name: 4-benzoyl-5-(4-cyanophenyl)-2-methyl-1-(3-methyl-1-oxobutyl)-3-phenyl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-benzoyl-5-(4-cyanophenyl)-2-methyl-1-(3-methylbutanoyl)-3-phenylpyrrolidine-2-carboxylic acid Traditional Name: 4-benzoyl-5-(4-cyanophenyl)-1-isovaleryl-2-methyl-3-phenyl-proline Formula: C31H30N2O4 MolecularWeight: 494.5809

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1C(C(C(C1(C)C(=O)O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC(C)CC(=O)N1C(C(C(C1(C)C(=O)O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C31H30N2O4/c1-20(2)18-25(34)33-28(23-16-14-21(19-32)15-17-23)26(29(35)24-12-8-5-9-13-24)27(31(33,3)30(36)37)22-10-6-4-7-11-22/h4-17,20,26-28H,18H2,1-3H3,(H,36,37)