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

Systemtic Name: N-[3-(imidazol-1-ylmethyl)phenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-[3-(imidazol-1-ylmethyl)phenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-[3-(1-imidazolylmethyl)phenyl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-[3-(imidazol-1-ylmethyl)phenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-[3-(imidazol-1-ylmethyl)phenyl]-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C25H26N4O2 MolecularWeight: 414.49954

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC(=C2)CN3C=CN=C3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC(=C2)CN3C=CN=C3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H26N4O2/c30-24(10-9-20-5-2-1-3-6-20)29-14-11-22(12-15-29)25(31)27-23-8-4-7-21(17-23)18-28-16-13-26-19-28/h1-10,13,16-17,19,22H,11-12,14-15,18H2,(H,27,31)/b10-9+