1-[4-(1-benzofuran-2-ylcarbonyl)piperazin-1-yl]-2-(3-oxidanyl-1-adamantyl)ethanone

Systemtic Name: 1-[4-(1-benzofuran-2-ylcarbonyl)piperazin-1-yl]-2-(3-oxidanyl-1-adamantyl)ethanone Openeye Name: 1-[4-(benzofuran-2-carbonyl)piperazin-1-yl]-2-(3-hydroxy-1-adamantyl)ethanone CAS Name: 1-[4-[2-benzofuranyl(oxo)methyl]-1-piperazinyl]-2-(3-hydroxy-1-adamantyl)ethanone IUPAC Name: 1-[4-(1-benzofuran-2-carbonyl)piperazin-1-yl]-2-(3-hydroxy-1-adamantyl)ethanone Traditional Name: 1-[4-(benzofuran-2-carbonyl)piperazino]-2-(3-hydroxy-1-adamantyl)ethanone Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC23CC4CC(C2)CC(C4)(C3)O)C(=O)C5=CC6=CC=CC=C6O5

Isomeric SMILES

C1CN(CCN1C(=O)CC23CC4CC(C2)CC(C4)(C3)O)C(=O)C5=CC6=CC=CC=C6O5

InChI

InChI=1S/C25H30N2O4/c28-22(15-24-11-17-9-18(12-24)14-25(30,13-17)16-24)26-5-7-27(8-6-26)23(29)21-10-19-3-1-2-4-20(19)31-21/h1-4,10,17-18,30H,5-9,11-16H2