methyl 5-aminocarbonyl-1-[(4-fluorophenyl)carbamoyl]-2-(4-methylphenyl)pyrrolidine-3-carboxylate

Systemtic Name: methyl 5-aminocarbonyl-1-[(4-fluorophenyl)carbamoyl]-2-(4-methylphenyl)pyrrolidine-3-carboxylate Openeye Name: methyl 5-carbamoyl-1-[(4-fluorophenyl)carbamoyl]-2-(p-tolyl)pyrrolidine-3-carboxylate CAS Name: 5-carbamoyl-1-[(4-fluoroanilino)-oxomethyl]-2-(4-methylphenyl)-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 5-carbamoyl-1-[(4-fluorophenyl)carbamoyl]-2-(4-methylphenyl)pyrrolidine-3-carboxylate Traditional Name: 5-carbamoyl-1-[(4-fluorophenyl)carbamoyl]-2-(p-tolyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C21H22FN3O4 MolecularWeight: 399.415483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(CC(N2C(=O)NC3=CC=C(C=C3)F)C(=O)N)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2C(CC(N2C(=O)NC3=CC=C(C=C3)F)C(=O)N)C(=O)OC

InChI

InChI=1S/C21H22FN3O4/c1-12-3-5-13(6-4-12)18-16(20(27)29-2)11-17(19(23)26)25(18)21(28)24-15-9-7-14(22)8-10-15/h3-10,16-18H,11H2,1-2H3,(H2,23,26)(H,24,28)