N-(2-azanylethyl)-1-ethanoyl-4-[(4-fluorophenyl)methyl-phenethyl-amino]pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-ethanoyl-4-[(4-fluorophenyl)methyl-phenethyl-amino]pyrrolidine-2-carboxamide Openeye Name: 1-acetyl-N-(2-aminoethyl)-4-[(4-fluorophenyl)methyl-phenethyl-amino]pyrrolidine-2-carboxamide CAS Name: 1-acetyl-N-(2-aminoethyl)-4-[(4-fluorophenyl)methyl-phenethylamino]-2-pyrrolidinecarboxamide IUPAC Name: 1-acetyl-N-(2-aminoethyl)-4-[(4-fluorophenyl)methyl-phenethylamino]pyrrolidine-2-carboxamide Traditional Name: 1-acetyl-N-(2-aminoethyl)-4-[(4-fluorobenzyl)-phenethyl-amino]pyrrolidine-2-carboxamide Formula: C24H31FN4O2 MolecularWeight: 426.526943

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(CC1C(=O)NCCN)N(CCC2=CC=CC=C2)CC3=CC=C(C=C3)F

Isomeric SMILES

CC(=O)N1CC(CC1C(=O)NCCN)N(CCC2=CC=CC=C2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C24H31FN4O2/c1-18(30)29-17-22(15-23(29)24(31)27-13-12-26)28(14-11-19-5-3-2-4-6-19)16-20-7-9-21(25)10-8-20/h2-10,22-23H,11-17,26H2,1H3,(H,27,31)