1-(3-cyanophenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: 1-(3-cyanophenyl)carbonylpiperidine-4-carboxylate Openeye Name: 1-(3-cyanobenzoyl)piperidine-4-carboxylate CAS Name: 1-[(3-cyanophenyl)-oxomethyl]-4-piperidinecarboxylate IUPAC Name: 1-(3-cyanobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(3-cyanobenzoyl)isonipecotate Formula: C14H13N2O3- MolecularWeight: 257.26462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N2O3/c15-9-10-2-1-3-12(8-10)13(17)16-6-4-11(5-7-16)14(18)19/h1-3,8,11H,4-7H2,(H,18,19)/p-1