4-ethoxycarbonyl-1-[(4-fluorophenyl)carbamoyl]-5-(4-methoxyphenyl)-2-methyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 4-ethoxycarbonyl-1-[(4-fluorophenyl)carbamoyl]-5-(4-methoxyphenyl)-2-methyl-pyrrolidine-2-carboxylic acid Openeye Name: 4-ethoxycarbonyl-1-[(4-fluorophenyl)carbamoyl]-5-(4-methoxyphenyl)-2-methyl-pyrrolidine-2-carboxylic acid CAS Name: 4-ethoxycarbonyl-1-[(4-fluoroanilino)-oxomethyl]-5-(4-methoxyphenyl)-2-methyl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-ethoxycarbonyl-1-[(4-fluorophenyl)carbamoyl]-5-(4-methoxyphenyl)-2-methylpyrrolidine-2-carboxylic acid Traditional Name: 4-carbethoxy-1-[(4-fluorophenyl)carbamoyl]-5-(4-methoxyphenyl)-2-methyl-proline Formula: C23H25FN2O6 MolecularWeight: 444.452803

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(N(C1C2=CC=C(C=C2)OC)C(=O)NC3=CC=C(C=C3)F)(C)C(=O)O

Isomeric SMILES

CCOC(=O)C1CC(N(C1C2=CC=C(C=C2)OC)C(=O)NC3=CC=C(C=C3)F)(C)C(=O)O

InChI

InChI=1S/C23H25FN2O6/c1-4-32-20(27)18-13-23(2,21(28)29)26(19(18)14-5-11-17(31-3)12-6-14)22(30)25-16-9-7-15(24)8-10-16/h5-12,18-19H,4,13H2,1-3H3,(H,25,30)(H,28,29)