N-(2-azanylethyl)-1-(2-methoxyethanoyl)-4-[(4-methylphenyl)methyl-phenethyl-amino]pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(2-methoxyethanoyl)-4-[(4-methylphenyl)methyl-phenethyl-amino]pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(2-methoxyacetyl)-4-[phenethyl(p-tolylmethyl)amino]pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-(2-methoxy-1-oxoethyl)-4-[(4-methylphenyl)methyl-phenethylamino]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-1-(2-methoxyacetyl)-4-[(4-methylphenyl)methyl-phenethylamino]pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(2-methoxyacetyl)-4-[(4-methylbenzyl)-phenethyl-amino]pyrrolidine-2-carboxamide Formula: C26H36N4O3 MolecularWeight: 452.58904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)COC)C(=O)NCCN

Isomeric SMILES

CC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)COC)C(=O)NCCN

InChI

InChI=1S/C26H36N4O3/c1-20-8-10-22(11-9-20)17-29(15-12-21-6-4-3-5-7-21)23-16-24(26(32)28-14-13-27)30(18-23)25(31)19-33-2/h3-11,23-24H,12-19,27H2,1-2H3,(H,28,32)