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

Systemtic Name: 5-(4-cyanophenyl)-1-(3,3-dimethylbutanoyl)-2-methyl-3-phenyl-4-(phenylcarbonyl)pyrrolidine-2-carboxylic acid Openeye Name: 4-benzoyl-5-(4-cyanophenyl)-1-(3,3-dimethylbutanoyl)-2-methyl-3-phenyl-pyrrolidine-2-carboxylic acid CAS Name: 4-benzoyl-5-(4-cyanophenyl)-1-(3,3-dimethyl-1-oxobutyl)-2-methyl-3-phenyl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-benzoyl-5-(4-cyanophenyl)-1-(3,3-dimethylbutanoyl)-2-methyl-3-phenylpyrrolidine-2-carboxylic acid Traditional Name: 4-benzoyl-5-(4-cyanophenyl)-1-(3,3-dimethylbutanoyl)-2-methyl-3-phenyl-proline Formula: C32H32N2O4 MolecularWeight: 508.60748

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C(N1C(=O)CC(C)(C)C)C2=CC=C(C=C2)C#N)C(=O)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1(C(C(C(N1C(=O)CC(C)(C)C)C2=CC=C(C=C2)C#N)C(=O)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C32H32N2O4/c1-31(2,3)19-25(35)34-28(23-17-15-21(20-33)16-18-23)26(29(36)24-13-9-6-10-14-24)27(32(34,4)30(37)38)22-11-7-5-8-12-22/h5-18,26-28H,19H2,1-4H3,(H,37,38)