diethyl 2-methyl-2-[4-(4-pyridin-2-ylpiperazin-1-yl)butyl]propanedioate

Systemtic Name: diethyl 2-methyl-2-[4-(4-pyridin-2-ylpiperazin-1-yl)butyl]propanedioate Openeye Name: diethyl 2-methyl-2-[4-[4-(2-pyridyl)piperazin-1-yl]butyl]propanedioate CAS Name: 2-methyl-2-[4-[4-(2-pyridinyl)-1-piperazinyl]butyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-methyl-2-[4-(4-pyridin-2-ylpiperazin-1-yl)butyl]propanedioate Traditional Name: 2-methyl-2-[4-[4-(2-pyridyl)piperazino]butyl]malonic acid diethyl ester Formula: C21H33N3O4 MolecularWeight: 391.50442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(CCCCN1CCN(CC1)C2=CC=CC=N2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C)(CCCCN1CCN(CC1)C2=CC=CC=N2)C(=O)OCC

InChI

InChI=1S/C21H33N3O4/c1-4-27-19(25)21(3,20(26)28-5-2)11-7-9-13-23-14-16-24(17-15-23)18-10-6-8-12-22-18/h6,8,10,12H,4-5,7,9,11,13-17H2,1-3H3