2-(1-adamantyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone

Systemtic Name: 2-(1-adamantyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Openeye Name: 2-(1-adamantyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone CAS Name: 2-(1-adamantyl)-1-(4-methyl-1-piperazin-4-iumyl)ethanone IUPAC Name: 2-(1-adamantyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Traditional Name: 2-(1-adamantyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Formula: C17H29N2O+ MolecularWeight: 277.42496

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C17H28N2O/c1-18-2-4-19(5-3-18)16(20)12-17-9-13-6-14(10-17)8-15(7-13)11-17/h13-15H,2-12H2,1H3/p+1