1-[(E)-3-phenylprop-2-enoyl]-N-[3-(2-pyridin-2-ylethynyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-[(E)-3-phenylprop-2-enoyl]-N-[3-(2-pyridin-2-ylethynyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-[(E)-3-phenylprop-2-enoyl]-N-[3-[2-(2-pyridyl)ethynyl]phenyl]piperidine-4-carboxamide CAS Name: 1-[(E)-1-oxo-3-phenylprop-2-enyl]-N-[3-[2-(2-pyridinyl)ethynyl]phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[(E)-3-phenylprop-2-enoyl]-N-[3-(2-pyridin-2-ylethynyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-[(E)-3-phenylacryloyl]-N-[3-[2-(2-pyridyl)ethynyl]phenyl]isonipecotamide Formula: C28H25N3O2 MolecularWeight: 435.517

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC(=C2)C#CC3=CC=CC=N3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC(=C2)C#CC3=CC=CC=N3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C28H25N3O2/c32-27(15-13-22-7-2-1-3-8-22)31-19-16-24(17-20-31)28(33)30-26-11-6-9-23(21-26)12-14-25-10-4-5-18-29-25/h1-11,13,15,18,21,24H,16-17,19-20H2,(H,30,33)/b15-13+