1-(1-adamantyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethanone dichloride

Systemtic Name: 1-(1-adamantyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethanone dichloride Openeye Name: 1-(1-adamantyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethanone dichloride CAS Name: 1-(1-adamantyl)-2-(4-methyl-1-piperazine-1,4-diiumyl)ethanone dichloride IUPAC Name: 1-(1-adamantyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethanone dichloride Traditional Name: 1-(1-adamantyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethanone dichloride Formula: C17H30Cl2N2O MolecularWeight: 349.3389

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H28N2O.2ClH/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;2*1H