5,6-dimethyl-3-oxidanylidene-2-[(4-oxidanylpiperidin-1-ium-1-yl)methyl]pyridazine-4-carbonitrile

Systemtic Name: 5,6-dimethyl-3-oxidanylidene-2-[(4-oxidanylpiperidin-1-ium-1-yl)methyl]pyridazine-4-carbonitrile Openeye Name: 2-[(4-hydroxypiperidin-1-ium-1-yl)methyl]-5,6-dimethyl-3-oxo-pyridazine-4-carbonitrile CAS Name: 2-[(4-hydroxy-1-piperidin-1-iumyl)methyl]-5,6-dimethyl-3-oxo-4-pyridazinecarbonitrile IUPAC Name: 2-[(4-hydroxypiperidin-1-ium-1-yl)methyl]-5,6-dimethyl-3-oxopyridazine-4-carbonitrile Traditional Name: 2-[(4-hydroxypiperidin-1-ium-1-yl)methyl]-3-keto-5,6-dimethyl-pyridazine-4-carbonitrile Formula: C13H19N4O2+ MolecularWeight: 263.31556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)C[NH+]2CCC(CC2)O)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)C[NH+]2CCC(CC2)O)C#N

InChI

InChI=1S/C13H18N4O2/c1-9-10(2)15-17(13(19)12(9)7-14)8-16-5-3-11(18)4-6-16/h11,18H,3-6,8H2,1-2H3/p+1