1-butyl-6-oxidanylidene-N-(3-oxidanylpyridin-1-ium-2-yl)pyridazine-3-carboxamide

Systemtic Name: 1-butyl-6-oxidanylidene-N-(3-oxidanylpyridin-1-ium-2-yl)pyridazine-3-carboxamide Openeye Name: 1-butyl-N-(3-hydroxypyridin-1-ium-2-yl)-6-oxo-pyridazine-3-carboxamide CAS Name: 1-butyl-N-(3-hydroxy-2-pyridin-1-iumyl)-6-oxo-3-pyridazinecarboxamide IUPAC Name: 1-butyl-N-(3-hydroxypyridin-1-ium-2-yl)-6-oxopyridazine-3-carboxamide Traditional Name: 1-butyl-N-(3-hydroxypyridin-1-ium-2-yl)-6-keto-pyridazine-3-carboxamide Formula: C14H17N4O3+ MolecularWeight: 289.30978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C=CC(=N1)C(=O)NC2=C(C=CC=[NH+]2)O

Isomeric SMILES

CCCCN1C(=O)C=CC(=N1)C(=O)NC2=C(C=CC=[NH+]2)O

InChI

InChI=1S/C14H16N4O3/c1-2-3-9-18-12(20)7-6-10(17-18)14(21)16-13-11(19)5-4-8-15-13/h4-8,19H,2-3,9H2,1H3,(H,15,16,21)/p+1