(2Z)-2-(1-azoniabicyclo[2.2.2]octan-3-ylidene)-2-phenyl-ethanenitrile

Systemtic Name: (2Z)-2-(1-azoniabicyclo[2.2.2]octan-3-ylidene)-2-phenyl-ethanenitrile Openeye Name: (2Z)-2-phenyl-2-quinuclidin-1-ium-3-ylidene-acetonitrile CAS Name: (2Z)-2-(1-azoniabicyclo[2.2.2]octan-3-ylidene)-2-phenylacetonitrile IUPAC Name: (2Z)-2-(1-azoniabicyclo[2.2.2]octan-3-ylidene)-2-phenylacetonitrile Traditional Name: (2Z)-2-phenyl-2-quinuclidin-1-ium-3-ylidene-acetonitrile Formula: C15H17N2+ MolecularWeight: 225.30888

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(=C(C#N)C3=CC=CC=C3)C2

Isomeric SMILES

C1C[NH+]2CCC1/C(=C(/C#N)\C3=CC=CC=C3)/C2

InChI

InChI=1S/C15H16N2/c16-10-14(12-4-2-1-3-5-12)15-11-17-8-6-13(15)7-9-17/h1-5,13H,6-9,11H2/p+1/b15-14-