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

Systemtic Name: 5-(4-cyanophenyl)-4-methoxycarbonyl-3-methyl-1-[(3-methylphenyl)carbamoyl]pyrrolidine-2-carboxylic acid Openeye Name: 5-(4-cyanophenyl)-4-methoxycarbonyl-3-methyl-1-(m-tolylcarbamoyl)pyrrolidine-2-carboxylic acid CAS Name: 5-(4-cyanophenyl)-4-methoxycarbonyl-3-methyl-1-[(3-methylanilino)-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(4-cyanophenyl)-4-methoxycarbonyl-3-methyl-1-[(3-methylphenyl)carbamoyl]pyrrolidine-2-carboxylic acid Traditional Name: 4-carbomethoxy-5-(4-cyanophenyl)-3-methyl-1-(m-tolylcarbamoyl)proline Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N3O5/c1-13-5-4-6-17(11-13)25-23(30)26-19(21(27)28)14(2)18(22(29)31-3)20(26)16-9-7-15(12-24)8-10-16/h4-11,14,18-20H,1-3H3,(H,25,30)(H,27,28)