4-methyl-6-oxidanyl-2-oxidanylidene-5-(piperidin-1-ium-1-ylmethyl)-1-propyl-pyridine-3-carbonitrile

Systemtic Name: 4-methyl-6-oxidanyl-2-oxidanylidene-5-(piperidin-1-ium-1-ylmethyl)-1-propyl-pyridine-3-carbonitrile Openeye Name: 6-hydroxy-4-methyl-2-oxo-5-(piperidin-1-ium-1-ylmethyl)-1-propyl-pyridine-3-carbonitrile CAS Name: 6-hydroxy-4-methyl-2-oxo-5-(1-piperidin-1-iumylmethyl)-1-propyl-3-pyridinecarbonitrile IUPAC Name: 6-hydroxy-4-methyl-2-oxo-5-(piperidin-1-ium-1-ylmethyl)-1-propylpyridine-3-carbonitrile Traditional Name: 6-hydroxy-2-keto-4-methyl-5-(piperidin-1-ium-1-ylmethyl)-1-propyl-nicotinonitrile Formula: C16H24N3O2+ MolecularWeight: 290.38066

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=C(C1=O)C#N)C)C[NH+]2CCCCC2)O

Isomeric SMILES

CCCN1C(=C(C(=C(C1=O)C#N)C)C[NH+]2CCCCC2)O

InChI

InChI=1S/C16H23N3O2/c1-3-7-19-15(20)13(10-17)12(2)14(16(19)21)11-18-8-5-4-6-9-18/h21H,3-9,11H2,1-2H3/p+1