diethyl 2-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]propanedioate

Systemtic Name: diethyl 2-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]propanedioate Openeye Name: diethyl 2-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]propanedioate CAS Name: 2-[2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]propanedioate Traditional Name: 2-[2-[4-(2-pyrimidyl)piperazino]ethyl]malonic acid diethyl ester Formula: C17H26N4O4 MolecularWeight: 350.41274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCN1CCN(CC1)C2=NC=CC=N2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CCN1CCN(CC1)C2=NC=CC=N2)C(=O)OCC

InChI

InChI=1S/C17H26N4O4/c1-3-24-15(22)14(16(23)25-4-2)6-9-20-10-12-21(13-11-20)17-18-7-5-8-19-17/h5,7-8,14H,3-4,6,9-13H2,1-2H3