2-(3-ethanoylphenoxy)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-(3-ethanoylphenoxy)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-(3-acetylphenoxy)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-(3-acetylphenoxy)-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(3-acetylphenoxy)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-(3-acetylphenoxy)-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C18H20N4O3 MolecularWeight: 340.3764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)OCC(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)OCC(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C18H20N4O3/c1-14(23)15-4-2-5-16(12-15)25-13-17(24)21-8-10-22(11-9-21)18-19-6-3-7-20-18/h2-7,12H,8-11,13H2,1H3