2-azanyl-4-(cyanomethyl)-6-(4-methylpiperidin-1-yl)pyridin-1-ium-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-(cyanomethyl)-6-(4-methylpiperidin-1-yl)pyridin-1-ium-3,5-dicarbonitrile Openeye Name: 2-amino-4-(cyanomethyl)-6-(4-methyl-1-piperidyl)pyridin-1-ium-3,5-dicarbonitrile CAS Name: 2-amino-4-(cyanomethyl)-6-(4-methyl-1-piperidinyl)pyridin-1-ium-3,5-dicarbonitrile IUPAC Name: 2-amino-4-(cyanomethyl)-6-(4-methylpiperidin-1-yl)pyridin-1-ium-3,5-dicarbonitrile Traditional Name: 2-amino-4-(cyanomethyl)-6-(4-methylpiperidino)pyridin-1-ium-3,5-dicarbonitrile Formula: C15H17N6+ MolecularWeight: 281.33568

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=[NH+]C(=C(C(=C2C#N)CC#N)C#N)N

Isomeric SMILES

CC1CCN(CC1)C2=[NH+]C(=C(C(=C2C#N)CC#N)C#N)N

InChI

InChI=1S/C15H16N6/c1-10-3-6-21(7-4-10)15-13(9-18)11(2-5-16)12(8-17)14(19)20-15/h10H,2-4,6-7H2,1H3,(H2,19,20)/p+1