2-(1,4-diazepan-1-ium-1-yl)-1-(4-methylpiperazin-1-yl)ethanone

Systemtic Name: 2-(1,4-diazepan-1-ium-1-yl)-1-(4-methylpiperazin-1-yl)ethanone Openeye Name: 2-(1,4-diazepan-1-ium-1-yl)-1-(4-methylpiperazin-1-yl)ethanone CAS Name: 2-(1,4-diazepan-1-ium-1-yl)-1-(4-methyl-1-piperazinyl)ethanone IUPAC Name: 2-(1,4-diazepan-1-ium-1-yl)-1-(4-methylpiperazin-1-yl)ethanone Traditional Name: 2-(1,4-diazepan-1-ium-1-yl)-1-(4-methylpiperazino)ethanone Formula: C12H25N4O+ MolecularWeight: 241.3531

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C[NH+]2CCCNCC2

Isomeric SMILES

CN1CCN(CC1)C(=O)C[NH+]2CCCNCC2

InChI

InChI=1S/C12H24N4O/c1-14-7-9-16(10-8-14)12(17)11-15-5-2-3-13-4-6-15/h13H,2-11H2,1H3/p+1