1-[[2-[(E)-hydroxyiminomethyl]-2H-pyridin-1-yl]methoxymethyl]pyridin-1-ium-4-carboxamide

Systemtic Name: 1-[[2-[(E)-hydroxyiminomethyl]-2H-pyridin-1-yl]methoxymethyl]pyridin-1-ium-4-carboxamide Openeye Name: 1-[[2-[(E)-hydroxyiminomethyl]-2H-pyridin-1-yl]methoxymethyl]pyridin-1-ium-4-carboxamide CAS Name: 1-[[2-[(E)-hydroxyiminomethyl]-2H-pyridin-1-yl]methoxymethyl]-4-pyridin-1-iumcarboxamide IUPAC Name: 1-[[2-[(E)-hydroxyiminomethyl]-2H-pyridin-1-yl]methoxymethyl]pyridin-1-ium-4-carboxamide Traditional Name: 1-[[2-[(E)-hydroximinomethyl]-2H-pyridin-1-yl]methoxymethyl]pyridin-1-ium-4-carboxamide Formula: C14H17N4O3+ MolecularWeight: 289.30978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(N(C=C1)COC[N+]2=CC=C(C=C2)C(=O)N)C=NO

Isomeric SMILES

C1=CC(N(C=C1)COC[N+]2=CC=C(C=C2)C(=O)N)/C=N/O

InChI

InChI=1S/C14H16N4O3/c15-14(19)12-4-7-17(8-5-12)10-21-11-18-6-2-1-3-13(18)9-16-20/h1-9,13H,10-11H2,(H2-,15,19,20)/p+1/b16-9+