2-piperazin-4-ium-1-ylpyridine-4-carbonitrile

Systemtic Name: 2-piperazin-4-ium-1-ylpyridine-4-carbonitrile Openeye Name: 2-piperazin-4-ium-1-ylpyridine-4-carbonitrile CAS Name: 2-(1-piperazin-4-iumyl)-4-pyridinecarbonitrile IUPAC Name: 2-piperazin-4-ium-1-ylpyridine-4-carbonitrile Traditional Name: 2-piperazin-4-ium-1-ylisonicotinonitrile Formula: C10H13N4+ MolecularWeight: 189.23702

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NC=CC(=C2)C#N

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NC=CC(=C2)C#N

InChI

InChI=1S/C10H12N4/c11-8-9-1-2-13-10(7-9)14-5-3-12-4-6-14/h1-2,7,12H,3-6H2/p+1