1-[(S)-cyano(pyridin-3-yl)methyl]piperidine-4-carboxylate

Systemtic Name: 1-[(S)-cyano(pyridin-3-yl)methyl]piperidine-4-carboxylate Openeye Name: 1-[(S)-cyano(3-pyridyl)methyl]piperidine-4-carboxylate CAS Name: 1-[(S)-cyano(3-pyridinyl)methyl]-4-piperidinecarboxylate IUPAC Name: 1-[(S)-cyano(pyridin-3-yl)methyl]piperidine-4-carboxylate Traditional Name: 1-[(S)-cyano(3-pyridyl)methyl]isonipecotate Formula: C13H14N3O2- MolecularWeight: 244.26916

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)[O-])C(C#N)C2=CN=CC=C2

Isomeric SMILES

C1CN(CCC1C(=O)[O-])[C@H](C#N)C2=CN=CC=C2

InChI

InChI=1S/C13H15N3O2/c14-8-12(11-2-1-5-15-9-11)16-6-3-10(4-7-16)13(17)18/h1-2,5,9-10,12H,3-4,6-7H2,(H,17,18)/p-1/t12-/m1/s1