6-(4-propylpiperazin-4-ium-1-yl)pyridine-3-carbonitrile

Systemtic Name: 6-(4-propylpiperazin-4-ium-1-yl)pyridine-3-carbonitrile Openeye Name: 6-(4-propylpiperazin-4-ium-1-yl)pyridine-3-carbonitrile CAS Name: 6-(4-propyl-1-piperazin-4-iumyl)-3-pyridinecarbonitrile IUPAC Name: 6-(4-propylpiperazin-4-ium-1-yl)pyridine-3-carbonitrile Traditional Name: 6-(4-propylpiperazin-4-ium-1-yl)nicotinonitrile Formula: C13H19N4+ MolecularWeight: 231.31676

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C2=NC=C(C=C2)C#N

Isomeric SMILES

CCC[NH+]1CCN(CC1)C2=NC=C(C=C2)C#N

InChI

InChI=1S/C13H18N4/c1-2-5-16-6-8-17(9-7-16)13-4-3-12(10-14)11-15-13/h3-4,11H,2,5-9H2,1H3/p+1