1-[4-(1-adamantyl)piperazin-4-ium-1-yl]-2-(4-ethoxyphenyl)ethanone

Systemtic Name: 1-[4-(1-adamantyl)piperazin-4-ium-1-yl]-2-(4-ethoxyphenyl)ethanone Openeye Name: 1-[4-(1-adamantyl)piperazin-4-ium-1-yl]-2-(4-ethoxyphenyl)ethanone CAS Name: 1-[4-(1-adamantyl)-1-piperazin-4-iumyl]-2-(4-ethoxyphenyl)ethanone IUPAC Name: 1-[4-(1-adamantyl)piperazin-4-ium-1-yl]-2-(4-ethoxyphenyl)ethanone Traditional Name: 1-[4-(1-adamantyl)piperazin-4-ium-1-yl]-2-p-phenetyl-ethanone Formula: C24H35N2O2+ MolecularWeight: 383.5469

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC(=O)N2CC[NH+](CC2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC1=CC=C(C=C1)CC(=O)N2CC[NH+](CC2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H34N2O2/c1-2-28-22-5-3-18(4-6-22)14-23(27)25-7-9-26(10-8-25)24-15-19-11-20(16-24)13-21(12-19)17-24/h3-6,19-21H,2,7-17H2,1H3/p+1