5-ethanoyl-6-methyl-2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-carbonitrile

Systemtic Name: 5-ethanoyl-6-methyl-2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-carbonitrile Openeye Name: 5-acetyl-6-methyl-2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-carbonitrile CAS Name: 5-acetyl-6-methyl-2-(4-methyl-1-piperazin-4-iumyl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 5-acetyl-6-methyl-2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-carbonitrile Traditional Name: 5-acetyl-6-methyl-2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-carbonitrile Formula: C14H20N4O+2 MolecularWeight: 260.3348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=[NH+]1)N2CC[NH+](CC2)C)C#N)C(=O)C

Isomeric SMILES

CC1=C(C=C(C(=[NH+]1)N2CC[NH+](CC2)C)C#N)C(=O)C

InChI

InChI=1S/C14H18N4O/c1-10-13(11(2)19)8-12(9-15)14(16-10)18-6-4-17(3)5-7-18/h8H,4-7H2,1-3H3/p+2