(2R)-2-piperidin-1-ium-1-yl-2-pyridin-3-yl-ethanenitrile

Systemtic Name: (2R)-2-piperidin-1-ium-1-yl-2-pyridin-3-yl-ethanenitrile Openeye Name: (2R)-2-piperidin-1-ium-1-yl-2-(3-pyridyl)acetonitrile CAS Name: (2R)-2-(1-piperidin-1-iumyl)-2-(3-pyridinyl)acetonitrile IUPAC Name: (2R)-2-piperidin-1-ium-1-yl-2-pyridin-3-ylacetonitrile Traditional Name: (2R)-2-piperidin-1-ium-1-yl-2-(3-pyridyl)acetonitrile Formula: C12H16N3+ MolecularWeight: 202.27554

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(C#N)C2=CN=CC=C2

Isomeric SMILES

C1CC[NH+](CC1)[C@@H](C#N)C2=CN=CC=C2

InChI

InChI=1S/C12H15N3/c13-9-12(11-5-4-6-14-10-11)15-7-2-1-3-8-15/h4-6,10,12H,1-3,7-8H2/p+1/t12-/m0/s1