N-[4-(4-chloranylphenoxy)butyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-[4-(4-chloranylphenoxy)butyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-[4-(4-chlorophenoxy)butyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-[4-(4-chlorophenoxy)butyl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-[4-(4-chlorophenoxy)butyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-[4-(4-chlorophenoxy)butyl]-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C25H29ClN2O3 MolecularWeight: 440.96236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCCCOC2=CC=C(C=C2)Cl)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)NCCCCOC2=CC=C(C=C2)Cl)C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C25H29ClN2O3/c26-22-9-11-23(12-10-22)31-19-5-4-16-27-25(30)21-14-17-28(18-15-21)24(29)13-8-20-6-2-1-3-7-20/h1-3,6-13,21H,4-5,14-19H2,(H,27,30)/b13-8+