N-[[3-(aminomethyl)cyclohexyl]methyl]-1-ethanoyl-4-[oxolan-2-ylmethyl-(phenylmethyl)amino]pyrrolidine-2-carboxamide

Systemtic Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-1-ethanoyl-4-[oxolan-2-ylmethyl-(phenylmethyl)amino]pyrrolidine-2-carboxamide Openeye Name: 1-acetyl-N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[benzyl(tetrahydrofuran-2-ylmethyl)amino]pyrrolidine-2-carboxamide CAS Name: 1-acetyl-N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[2-oxolanylmethyl-(phenylmethyl)amino]-2-pyrrolidinecarboxamide IUPAC Name: 1-acetyl-N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[benzyl(oxolan-2-ylmethyl)amino]pyrrolidine-2-carboxamide Traditional Name: 1-acetyl-N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[benzyl(tetrahydrofurfuryl)amino]pyrrolidine-2-carboxamide Formula: C27H42N4O3 MolecularWeight: 470.64738

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(CC1C(=O)NCC2CCCC(C2)CN)N(CC3CCCO3)CC4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CC(CC1C(=O)NCC2CCCC(C2)CN)N(CC3CCCO3)CC4=CC=CC=C4

InChI

InChI=1S/C27H42N4O3/c1-20(32)31-18-24(14-26(31)27(33)29-16-23-10-5-9-22(13-23)15-28)30(19-25-11-6-12-34-25)17-21-7-3-2-4-8-21/h2-4,7-8,22-26H,5-6,9-19,28H2,1H3,(H,29,33)