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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[NH+](CC1)CC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN1CC[NH+](CC1)CC(=O)C23CC4CC(C2)CC(C4)C3

InChI

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