1-(1-adamantyl)-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-(1-adamantyl)-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]ethanone Openeye Name: 1-(1-adamantyl)-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]ethanone CAS Name: 1-(1-adamantyl)-2-[4-(3-methoxyphenyl)-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-(1-adamantyl)-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]ethanone Traditional Name: 1-(1-adamantyl)-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]ethanone Formula: C23H33N2O2+ MolecularWeight: 369.52032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC[NH+](CC2)CC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=CC(=C1)N2CC[NH+](CC2)CC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H32N2O2/c1-27-21-4-2-3-20(12-21)25-7-5-24(6-8-25)16-22(26)23-13-17-9-18(14-23)11-19(10-17)15-23/h2-4,12,17-19H,5-11,13-16H2,1H3/p+1