1-(2-azanylethanoyl)-5-(2-fluorophenyl)-4-[(phenylmethyl)carbamoyl]pyrrolidine-2-carboxylate

Systemtic Name: 1-(2-azanylethanoyl)-5-(2-fluorophenyl)-4-[(phenylmethyl)carbamoyl]pyrrolidine-2-carboxylate Openeye Name: 1-(2-aminoacetyl)-4-(benzylcarbamoyl)-5-(2-fluorophenyl)pyrrolidine-2-carboxylate CAS Name: 1-(2-amino-1-oxoethyl)-5-(2-fluorophenyl)-4-[oxo-[(phenylmethyl)amino]methyl]-2-pyrrolidinecarboxylate IUPAC Name: 1-(2-aminoacetyl)-4-(benzylcarbamoyl)-5-(2-fluorophenyl)pyrrolidine-2-carboxylate Traditional Name: 4-(benzylcarbamoyl)-5-(2-fluorophenyl)-1-glycyl-pyrrolidine-2-carboxylate Formula: C21H21FN3O4- MolecularWeight: 398.407543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(N(C1C(=O)[O-])C(=O)CN)C2=CC=CC=C2F)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1C(C(N(C1C(=O)[O-])C(=O)CN)C2=CC=CC=C2F)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H22FN3O4/c22-16-9-5-4-8-14(16)19-15(10-17(21(28)29)25(19)18(26)11-23)20(27)24-12-13-6-2-1-3-7-13/h1-9,15,17,19H,10-12,23H2,(H,24,27)(H,28,29)/p-1