2-piperazin-1-ium-1-yl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-piperazin-1-ium-1-yl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-piperazin-1-ium-1-yl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-(1-piperazin-1-iumyl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-piperazin-1-ium-1-yl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-piperazin-1-ium-1-yl-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C14H23N6O+ MolecularWeight: 291.37202

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCN1)CC(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

C1C[NH+](CCN1)CC(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C14H22N6O/c21-13(12-18-6-4-15-5-7-18)19-8-10-20(11-9-19)14-16-2-1-3-17-14/h1-3,15H,4-12H2/p+1