1-(4-cyanophenyl)piperidine-4-carboxylate

Systemtic Name: 1-(4-cyanophenyl)piperidine-4-carboxylate Openeye Name: 1-(4-cyanophenyl)piperidine-4-carboxylate CAS Name: 1-(4-cyanophenyl)-4-piperidinecarboxylate IUPAC Name: 1-(4-cyanophenyl)piperidine-4-carboxylate Traditional Name: 1-(4-cyanophenyl)isonipecotate Formula: C13H13N2O2- MolecularWeight: 229.25452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O2/c14-9-10-1-3-12(4-2-10)15-7-5-11(6-8-15)13(16)17/h1-4,11H,5-8H2,(H,16,17)/p-1