methyl-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]azanium

Systemtic Name: methyl-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]azanium Openeye Name: methyl-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]ammonium CAS Name: methyl-[2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethyl]ammonium IUPAC Name: methyl-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]azanium Traditional Name: methyl-[2-(4-pyridin-1-ium-2-ylpiperazino)ethyl]ammonium Formula: C12H22N4+2 MolecularWeight: 222.32988

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CCN1CCN(CC1)C2=CC=CC=[NH+]2

Isomeric SMILES

C[NH2+]CCN1CCN(CC1)C2=CC=CC=[NH+]2

InChI

InChI=1S/C12H20N4/c1-13-6-7-15-8-10-16(11-9-15)12-4-2-3-5-14-12/h2-5,13H,6-11H2,1H3/p+2