6-[4-(2-methylpropyl)piperazin-4-ium-1-yl]pyridin-1-ium-3-amine

Systemtic Name: 6-[4-(2-methylpropyl)piperazin-4-ium-1-yl]pyridin-1-ium-3-amine Openeye Name: 6-(4-isobutylpiperazin-4-ium-1-yl)pyridin-1-ium-3-amine CAS Name: 6-[4-(2-methylpropyl)-1-piperazin-4-iumyl]-3-pyridin-1-iumamine IUPAC Name: 6-[4-(2-methylpropyl)piperazin-4-ium-1-yl]pyridin-1-ium-3-amine Traditional Name: [6-(4-isobutylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]amine Formula: C13H24N4+2 MolecularWeight: 236.35646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCN(CC1)C2=[NH+]C=C(C=C2)N

Isomeric SMILES

CC(C)C[NH+]1CCN(CC1)C2=[NH+]C=C(C=C2)N

InChI

InChI=1S/C13H22N4/c1-11(2)10-16-5-7-17(8-6-16)13-4-3-12(14)9-15-13/h3-4,9,11H,5-8,10,14H2,1-2H3/p+2