1-adamantyl-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: 1-adamantyl-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: 1-adamantyl-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: 1-adamantyl-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: 1-adamantyl-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: 1-adamantyl-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C16H27N2O+ MolecularWeight: 263.39838

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C16H26N2O/c1-17-2-4-18(5-3-17)15(19)16-9-12-6-13(10-16)8-14(7-12)11-16/h12-14H,2-11H2,1H3/p+1