N-(2-adamantyl)-4-[[[(1-ethanoylpiperidin-4-yl)-methyl-carbamoyl]-methyl-amino]methyl]benzamide

Systemtic Name: N-(2-adamantyl)-4-[[[(1-ethanoylpiperidin-4-yl)-methyl-carbamoyl]-methyl-amino]methyl]benzamide Openeye Name: 4-[[[(1-acetyl-4-piperidyl)-methyl-carbamoyl]-methyl-amino]methyl]-N-(2-adamantyl)benzamide CAS Name: 4-[[[[(1-acetyl-4-piperidinyl)-methylamino]-oxomethyl]-methylamino]methyl]-N-(2-adamantyl)benzamide IUPAC Name: 4-[[[(1-acetylpiperidin-4-yl)-methylcarbamoyl]-methylamino]methyl]-N-(2-adamantyl)benzamide Traditional Name: 4-[[[(1-acetyl-4-piperidyl)-methyl-carbamoyl]-methyl-amino]methyl]-N-(2-adamantyl)benzamide Formula: C28H40N4O3 MolecularWeight: 480.6422

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)N(C)C(=O)N(C)CC2=CC=C(C=C2)C(=O)NC3C4CC5CC(C4)CC3C5

Isomeric SMILES

CC(=O)N1CCC(CC1)N(C)C(=O)N(C)CC2=CC=C(C=C2)C(=O)NC3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C28H40N4O3/c1-18(33)32-10-8-25(9-11-32)31(3)28(35)30(2)17-19-4-6-22(7-5-19)27(34)29-26-23-13-20-12-21(15-23)16-24(26)14-20/h4-7,20-21,23-26H,8-17H2,1-3H3,(H,29,34)