N-(2-azanylethyl)-1-ethanoyl-4-[(4-methoxyphenyl)carbonyl-phenethyl-amino]pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-ethanoyl-4-[(4-methoxyphenyl)carbonyl-phenethyl-amino]pyrrolidine-2-carboxamide Openeye Name: 1-acetyl-N-(2-aminoethyl)-4-[(4-methoxybenzoyl)-phenethyl-amino]pyrrolidine-2-carboxamide CAS Name: 1-acetyl-N-(2-aminoethyl)-4-[[(4-methoxyphenyl)-oxomethyl]-phenethylamino]-2-pyrrolidinecarboxamide IUPAC Name: 1-acetyl-N-(2-aminoethyl)-4-[(4-methoxybenzoyl)-phenethylamino]pyrrolidine-2-carboxamide Traditional Name: 1-acetyl-N-(2-aminoethyl)-4-[p-anisoyl(phenethyl)amino]pyrrolidine-2-carboxamide Formula: C25H32N4O4 MolecularWeight: 452.54598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32N4O4/c1-18(30)29-17-21(16-23(29)24(31)27-14-13-26)28(15-12-19-6-4-3-5-7-19)25(32)20-8-10-22(33-2)11-9-20/h3-11,21,23H,12-17,26H2,1-2H3,(H,27,31)