5-(4-cyanophenyl)-4-methoxycarbonyl-1-(phenylcarbonyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(4-cyanophenyl)-4-methoxycarbonyl-1-(phenylcarbonyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-benzoyl-5-(4-cyanophenyl)-4-methoxycarbonyl-pyrrolidine-2-carboxylic acid CAS Name: 1-benzoyl-5-(4-cyanophenyl)-4-methoxycarbonyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-benzoyl-5-(4-cyanophenyl)-4-methoxycarbonylpyrrolidine-2-carboxylic acid Traditional Name: 1-benzoyl-4-carbomethoxy-5-(4-cyanophenyl)proline Formula: C21H18N2O5 MolecularWeight: 378.37802

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(N(C1C2=CC=C(C=C2)C#N)C(=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

COC(=O)C1CC(N(C1C2=CC=C(C=C2)C#N)C(=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H18N2O5/c1-28-21(27)16-11-17(20(25)26)23(19(24)15-5-3-2-4-6-15)18(16)14-9-7-13(12-22)8-10-14/h2-10,16-18H,11H2,1H3,(H,25,26)