1-[(3-chlorophenyl)carbamoyl]-5-(4-cyanophenyl)-2-methyl-3-phenyl-4-(phenylcarbonyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3-chlorophenyl)carbamoyl]-5-(4-cyanophenyl)-2-methyl-3-phenyl-4-(phenylcarbonyl)pyrrolidine-2-carboxylic acid Openeye Name: 4-benzoyl-1-[(3-chlorophenyl)carbamoyl]-5-(4-cyanophenyl)-2-methyl-3-phenyl-pyrrolidine-2-carboxylic acid CAS Name: 4-benzoyl-1-[(3-chloroanilino)-oxomethyl]-5-(4-cyanophenyl)-2-methyl-3-phenyl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-benzoyl-1-[(3-chlorophenyl)carbamoyl]-5-(4-cyanophenyl)-2-methyl-3-phenylpyrrolidine-2-carboxylic acid Traditional Name: 4-benzoyl-1-[(3-chlorophenyl)carbamoyl]-5-(4-cyanophenyl)-2-methyl-3-phenyl-proline Formula: C33H26ClN3O4 MolecularWeight: 564.03024

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C(N1C(=O)NC2=CC(=CC=C2)Cl)C3=CC=C(C=C3)C#N)C(=O)C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O

Isomeric SMILES

CC1(C(C(C(N1C(=O)NC2=CC(=CC=C2)Cl)C3=CC=C(C=C3)C#N)C(=O)C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C33H26ClN3O4/c1-33(31(39)40)28(22-9-4-2-5-10-22)27(30(38)24-11-6-3-7-12-24)29(23-17-15-21(20-35)16-18-23)37(33)32(41)36-26-14-8-13-25(34)19-26/h2-19,27-29H,1H3,(H,36,41)(H,39,40)