3,3-dimethyl-5-oxidanylidene-5-(4-pyrimidin-2-ylpiperazin-1-yl)pentanoate

Systemtic Name: 3,3-dimethyl-5-oxidanylidene-5-(4-pyrimidin-2-ylpiperazin-1-yl)pentanoate Openeye Name: 3,3-dimethyl-5-oxo-5-(4-pyrimidin-2-ylpiperazin-1-yl)pentanoate CAS Name: 3,3-dimethyl-5-oxo-5-[4-(2-pyrimidinyl)-1-piperazinyl]pentanoate IUPAC Name: 3,3-dimethyl-5-oxo-5-(4-pyrimidin-2-ylpiperazin-1-yl)pentanoate Traditional Name: 5-keto-3,3-dimethyl-5-[4-(2-pyrimidyl)piperazino]valerate Formula: C15H21N4O3- MolecularWeight: 305.35224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)N1CCN(CC1)C2=NC=CC=N2)CC(=O)[O-]

Isomeric SMILES

CC(C)(CC(=O)N1CCN(CC1)C2=NC=CC=N2)CC(=O)[O-]

InChI

InChI=1S/C15H22N4O3/c1-15(2,11-13(21)22)10-12(20)18-6-8-19(9-7-18)14-16-4-3-5-17-14/h3-5H,6-11H2,1-2H3,(H,21,22)/p-1