2-(1-oxidanidylquinolin-1-ium-4-yl)-2-pyridin-2-yl-ethanenitrile

Systemtic Name: 2-(1-oxidanidylquinolin-1-ium-4-yl)-2-pyridin-2-yl-ethanenitrile Openeye Name: 2-(1-oxidoquinolin-1-ium-4-yl)-2-(2-pyridyl)acetonitrile CAS Name: 2-(1-oxido-4-quinolin-1-iumyl)-2-(2-pyridinyl)acetonitrile IUPAC Name: 2-(1-oxidoquinolin-1-ium-4-yl)-2-pyridin-2-ylacetonitrile Traditional Name: 2-(1-oxidoquinolin-1-ium-4-yl)-2-(2-pyridyl)acetonitrile Formula: C16H11N3O MolecularWeight: 261.27804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=[N+]2[O-])C(C#N)C3=CC=CC=N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=[N+]2[O-])C(C#N)C3=CC=CC=N3

InChI

InChI=1S/C16H11N3O/c17-11-14(15-6-3-4-9-18-15)12-8-10-19(20)16-7-2-1-5-13(12)16/h1-10,14H