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

Systemtic Name: 1-[4-(1-adamantyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 1-[4-(1-adamantyl)piperazin-4-ium-1-yl]ethanone CAS Name: 1-[4-(1-adamantyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 1-[4-(1-adamantyl)piperazin-4-ium-1-yl]ethanone Traditional Name: 1-[4-(1-adamantyl)piperazin-4-ium-1-yl]ethanone Formula: C16H27N2O+ MolecularWeight: 263.39838

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C16H26N2O/c1-12(19)17-2-4-18(5-3-17)16-9-13-6-14(10-16)8-15(7-13)11-16/h13-15H,2-11H2,1H3/p+1