2-piperazin-4-ium-1-ylquinoline-3-carbonitrile

Systemtic Name: 2-piperazin-4-ium-1-ylquinoline-3-carbonitrile Openeye Name: 2-piperazin-4-ium-1-ylquinoline-3-carbonitrile CAS Name: 2-(1-piperazin-4-iumyl)-3-quinolinecarbonitrile IUPAC Name: 2-piperazin-4-ium-1-ylquinoline-3-carbonitrile Traditional Name: 2-piperazin-4-ium-1-ylquinoline-3-carbonitrile Formula: C14H15N4+ MolecularWeight: 239.2957

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NC3=CC=CC=C3C=C2C#N

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NC3=CC=CC=C3C=C2C#N

InChI

InChI=1S/C14H14N4/c15-10-12-9-11-3-1-2-4-13(11)17-14(12)18-7-5-16-6-8-18/h1-4,9,16H,5-8H2/p+1