5-[(1R,5S)-3,6-diazabicyclo[3.2.0]heptan-6-yl]-1-oxidanidyl-pyridin-1-ium-3-carbonitrile

Systemtic Name: 5-[(1R,5S)-3,6-diazabicyclo[3.2.0]heptan-6-yl]-1-oxidanidyl-pyridin-1-ium-3-carbonitrile Openeye Name: 5-[(1R,5S)-3,6-diazabicyclo[3.2.0]heptan-6-yl]-1-oxido-pyridin-1-ium-3-carbonitrile CAS Name: 5-[(1R,5S)-3,6-diazabicyclo[3.2.0]heptan-6-yl]-1-oxido-3-pyridin-1-iumcarbonitrile IUPAC Name: 5-[(1R,5S)-3,6-diazabicyclo[3.2.0]heptan-6-yl]-1-oxidopyridin-1-ium-3-carbonitrile Traditional Name: 5-[(1R,5S)-3,6-diazabicyclo[3.2.0]heptan-6-yl]-1-oxido-pyridin-1-ium-3-carbonitrile Formula: C11H12N4O MolecularWeight: 216.23918

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CN(C2CN1)C3=C[N+](=CC(=C3)C#N)[O-]

Isomeric SMILES

C1[C@@H]2CN([C@@H]2CN1)C3=C[N+](=CC(=C3)C#N)[O-]

InChI

InChI=1S/C11H12N4O/c12-2-8-1-10(7-14(16)5-8)15-6-9-3-13-4-11(9)15/h1,5,7,9,11,13H,3-4,6H2/t9-,11-/m1/s1