N-[1-(4-imidazol-1-ylphenyl)ethyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-[1-(4-imidazol-1-ylphenyl)ethyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-[1-(4-imidazol-1-ylphenyl)ethyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-[1-[4-(1-imidazolyl)phenyl]ethyl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-[1-(4-imidazol-1-ylphenyl)ethyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-[1-(4-imidazol-1-ylphenyl)ethyl]-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C26H28N4O2 MolecularWeight: 428.52612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)C3CCN(CC3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)C3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C26H28N4O2/c1-20(22-8-10-24(11-9-22)30-18-15-27-19-30)28-26(32)23-13-16-29(17-14-23)25(31)12-7-21-5-3-2-4-6-21/h2-12,15,18-20,23H,13-14,16-17H2,1H3,(H,28,32)/b12-7+