2-[1-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclohexyl]ethanoate

Systemtic Name: 2-[1-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclohexyl]ethanoate Openeye Name: 2-[1-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclohexyl]acetate CAS Name: 2-[1-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]cyclohexyl]acetate IUPAC Name: 2-[1-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclohexyl]acetate Traditional Name: 2-[1-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl]cyclohexyl]acetate Formula: C18H25N4O3- MolecularWeight: 345.4161

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CC(=O)N2CCN(CC2)C3=NC=CC=N3)CC(=O)[O-]

Isomeric SMILES

C1CCC(CC1)(CC(=O)N2CCN(CC2)C3=NC=CC=N3)CC(=O)[O-]

InChI

InChI=1S/C18H26N4O3/c23-15(13-18(14-16(24)25)5-2-1-3-6-18)21-9-11-22(12-10-21)17-19-7-4-8-20-17/h4,7-8H,1-3,5-6,9-14H2,(H,24,25)/p-1