2-[4-(3-methylbut-2-enyl)piperazin-4-ium-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-(3-methylbut-2-enyl)piperazin-4-ium-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-(3-methylbut-2-enyl)piperazin-4-ium-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-(3-methylbut-2-enyl)-1-piperazin-4-iumyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-(3-methylbut-2-enyl)piperazin-4-ium-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-(3-methylbut-2-enyl)piperazin-4-ium-1-yl]isonicotinonitrile Formula: C15H21N4+ MolecularWeight: 257.35404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N4/c1-13(2)4-6-18-7-9-19(10-8-18)15-11-14(12-16)3-5-17-15/h3-5,11H,6-10H2,1-2H3/p+1