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

Systemtic Name: N-(4-azanylcyclohexyl)-1-ethanoyl-4-[(4-methoxyphenyl)carbonyl-phenethyl-amino]pyrrolidine-2-carboxamide Openeye Name: 1-acetyl-N-(4-aminocyclohexyl)-4-[(4-methoxybenzoyl)-phenethyl-amino]pyrrolidine-2-carboxamide CAS Name: 1-acetyl-N-(4-aminocyclohexyl)-4-[[(4-methoxyphenyl)-oxomethyl]-phenethylamino]-2-pyrrolidinecarboxamide IUPAC Name: 1-acetyl-N-(4-aminocyclohexyl)-4-[(4-methoxybenzoyl)-phenethylamino]pyrrolidine-2-carboxamide Traditional Name: 1-acetyl-N-(4-aminocyclohexyl)-4-[p-anisoyl(phenethyl)amino]pyrrolidine-2-carboxamide Formula: C29H38N4O4 MolecularWeight: 506.63642

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(CC1C(=O)NC2CCC(CC2)N)N(CCC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(=O)N1CC(CC1C(=O)NC2CCC(CC2)N)N(CCC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C29H38N4O4/c1-20(34)33-19-25(18-27(33)28(35)31-24-12-10-23(30)11-13-24)32(17-16-21-6-4-3-5-7-21)29(36)22-8-14-26(37-2)15-9-22/h3-9,14-15,23-25,27H,10-13,16-19,30H2,1-2H3,(H,31,35)