N-(4-methoxy-2-methyl-phenyl)-3-[1-(3-phenylprop-2-ynoyl)piperidin-3-yl]propanamide

Systemtic Name: N-(4-methoxy-2-methyl-phenyl)-3-[1-(3-phenylprop-2-ynoyl)piperidin-3-yl]propanamide Openeye Name: N-(4-methoxy-2-methyl-phenyl)-3-[1-(3-phenylprop-2-ynoyl)-3-piperidyl]propanamide CAS Name: N-(4-methoxy-2-methylphenyl)-3-[1-(1-oxo-3-phenylprop-2-ynyl)-3-piperidinyl]propanamide IUPAC Name: N-(4-methoxy-2-methylphenyl)-3-[1-(3-phenylprop-2-ynoyl)piperidin-3-yl]propanamide Traditional Name: N-(4-methoxy-2-methyl-phenyl)-3-[1-(3-phenylpropioloyl)-3-piperidyl]propionamide Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)NC(=O)CCC2CCCN(C2)C(=O)C#CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)OC)NC(=O)CCC2CCCN(C2)C(=O)C#CC3=CC=CC=C3

InChI

InChI=1S/C25H28N2O3/c1-19-17-22(30-2)12-13-23(19)26-24(28)14-10-21-9-6-16-27(18-21)25(29)15-11-20-7-4-3-5-8-20/h3-5,7-8,12-13,17,21H,6,9-10,14,16,18H2,1-2H3,(H,26,28)