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

Systemtic Name: N-[2-[(2-nitrophenyl)amino]ethyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-[2-(2-nitroanilino)ethyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-[2-(2-nitroanilino)ethyl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(2-nitroanilino)ethyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-[2-(2-nitroanilino)ethyl]-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C23H26N4O4 MolecularWeight: 422.47694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCNC2=CC=CC=C2[N+](=O)[O-])C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)NCCNC2=CC=CC=C2[N+](=O)[O-])C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C23H26N4O4/c28-22(11-10-18-6-2-1-3-7-18)26-16-12-19(13-17-26)23(29)25-15-14-24-20-8-4-5-9-21(20)27(30)31/h1-11,19,24H,12-17H2,(H,25,29)/b11-10+