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

Systemtic Name: 1-[(3-chlorophenyl)carbamoyl]-5-(4-cyanophenyl)-4-methoxycarbonyl-3-methyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3-chlorophenyl)carbamoyl]-5-(4-cyanophenyl)-4-methoxycarbonyl-3-methyl-pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-chloroanilino)-oxomethyl]-5-(4-cyanophenyl)-4-methoxycarbonyl-3-methyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-chlorophenyl)carbamoyl]-5-(4-cyanophenyl)-4-methoxycarbonyl-3-methylpyrrolidine-2-carboxylic acid Traditional Name: 4-carbomethoxy-1-[(3-chlorophenyl)carbamoyl]-5-(4-cyanophenyl)-3-methyl-proline Formula: C22H20ClN3O5 MolecularWeight: 441.8643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(N(C1C(=O)O)C(=O)NC2=CC(=CC=C2)Cl)C3=CC=C(C=C3)C#N)C(=O)OC

Isomeric SMILES

CC1C(C(N(C1C(=O)O)C(=O)NC2=CC(=CC=C2)Cl)C3=CC=C(C=C3)C#N)C(=O)OC

InChI

InChI=1S/C22H20ClN3O5/c1-12-17(21(29)31-2)19(14-8-6-13(11-24)7-9-14)26(18(12)20(27)28)22(30)25-16-5-3-4-15(23)10-16/h3-10,12,17-19H,1-2H3,(H,25,30)(H,27,28)