N-[(3-methoxyphenyl)methyl]-3-[1-(3-phenylprop-2-ynoyl)piperidin-3-yl]propanamide

Systemtic Name: N-[(3-methoxyphenyl)methyl]-3-[1-(3-phenylprop-2-ynoyl)piperidin-3-yl]propanamide Openeye Name: N-[(3-methoxyphenyl)methyl]-3-[1-(3-phenylprop-2-ynoyl)-3-piperidyl]propanamide CAS Name: N-[(3-methoxyphenyl)methyl]-3-[1-(1-oxo-3-phenylprop-2-ynyl)-3-piperidinyl]propanamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-3-[1-(3-phenylprop-2-ynoyl)piperidin-3-yl]propanamide Traditional Name: N-m-anisyl-3-[1-(3-phenylpropioloyl)-3-piperidyl]propionamide Formula: C25H28N2O3 MolecularWeight: 404.50142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)CCC2CCCN(C2)C(=O)C#CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)CCC2CCCN(C2)C(=O)C#CC3=CC=CC=C3

InChI

InChI=1S/C25H28N2O3/c1-30-23-11-5-9-22(17-23)18-26-24(28)14-12-21-10-6-16-27(19-21)25(29)15-13-20-7-3-2-4-8-20/h2-5,7-9,11,17,21H,6,10,12,14,16,18-19H2,1H3,(H,26,28)