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

Systemtic Name: 1-[(E)-3-phenylprop-2-enoyl]-N-[4-(pyridin-4-ylmethyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-[(E)-3-phenylprop-2-enoyl]-N-[4-(4-pyridylmethyl)phenyl]piperidine-4-carboxamide CAS Name: 1-[(E)-1-oxo-3-phenylprop-2-enyl]-N-[4-(pyridin-4-ylmethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[(E)-3-phenylprop-2-enoyl]-N-[4-(pyridin-4-ylmethyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-[(E)-3-phenylacryloyl]-N-[4-(4-pyridylmethyl)phenyl]isonipecotamide Formula: C27H27N3O2 MolecularWeight: 425.52218

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O2/c31-26(11-8-21-4-2-1-3-5-21)30-18-14-24(15-19-30)27(32)29-25-9-6-22(7-10-25)20-23-12-16-28-17-13-23/h1-13,16-17,24H,14-15,18-20H2,(H,29,32)/b11-8+