2-azanyl-6-methoxy-4-pyridin-1-ium-4-yl-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-methoxy-4-pyridin-1-ium-4-yl-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-6-methoxy-4-pyridin-1-ium-4-yl-pyridine-3,5-dicarbonitrile CAS Name: 2-amino-6-methoxy-4-(4-pyridin-1-iumyl)pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-6-methoxy-4-pyridin-1-ium-4-ylpyridine-3,5-dicarbonitrile Traditional Name: 2-amino-6-methoxy-4-pyridin-1-ium-4-yl-dinicotinonitrile Formula: C13H10N5O+ MolecularWeight: 252.2514

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=N1)N)C#N)C2=CC=[NH+]C=C2)C#N

Isomeric SMILES

COC1=C(C(=C(C(=N1)N)C#N)C2=CC=[NH+]C=C2)C#N

InChI

InChI=1S/C13H9N5O/c1-19-13-10(7-15)11(8-2-4-17-5-3-8)9(6-14)12(16)18-13/h2-5H,1H3,(H2,16,18)/p+1