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

Systemtic Name: 1-[(E)-3-phenylprop-2-enoyl]-N-(pyridin-3-ylmethyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-[(E)-3-phenylprop-2-enoyl]-N-(3-pyridylmethyl)-N-(4-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-[(E)-1-oxo-3-phenylprop-2-enyl]-N-(3-pyridinylmethyl)-N-(pyridin-4-ylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-[(E)-3-phenylprop-2-enoyl]-N-(pyridin-3-ylmethyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-[(E)-3-phenylacryloyl]-N-(3-pyridylmethyl)-N-(4-pyridylmethyl)isonipecotamide Formula: C27H28N4O2 MolecularWeight: 440.53682

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N(CC2=CC=NC=C2)CC3=CN=CC=C3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)N(CC2=CC=NC=C2)CC3=CN=CC=C3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C27H28N4O2/c32-26(9-8-22-5-2-1-3-6-22)30-17-12-25(13-18-30)27(33)31(20-23-10-15-28-16-11-23)21-24-7-4-14-29-19-24/h1-11,14-16,19,25H,12-13,17-18,20-21H2/b9-8+