1-oxidanidyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyridin-1-ium-3-carboxamide

Systemtic Name: 1-oxidanidyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyridin-1-ium-3-carboxamide Openeye Name: 1-oxido-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyridin-1-ium-3-carboxamide CAS Name: 1-oxido-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)-3-pyridin-1-iumcarboxamide IUPAC Name: 1-oxido-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyridin-1-ium-3-carboxamide Traditional Name: 1-oxido-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyridin-1-ium-3-carboxamide Formula: C13H11N5O2 MolecularWeight: 269.25874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NN=C(N2C=C1)CNC(=O)C3=C[N+](=CC=C3)[O-]

Isomeric SMILES

C1=CC2=NN=C(N2C=C1)CNC(=O)C3=C[N+](=CC=C3)[O-]

InChI

InChI=1S/C13H11N5O2/c19-13(10-4-3-6-17(20)9-10)14-8-12-16-15-11-5-1-2-7-18(11)12/h1-7,9H,8H2,(H,14,19)