[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 1-oxidanylcyclohexane-1-carboxylate

Systemtic Name: [2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 1-oxidanylcyclohexane-1-carboxylate Openeye Name: [2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 1-hydroxycyclohexanecarboxylate CAS Name: 1-hydroxy-1-cyclohexanecarboxylic acid [2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl] ester IUPAC Name: [2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 1-hydroxycyclohexane-1-carboxylate Traditional Name: 1-hydroxycyclohexanecarboxylic acid [2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl] ester Formula: C17H24N4O4 MolecularWeight: 348.39686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)OCC(=O)N2CCN(CC2)C3=NC=CC=N3)O

Isomeric SMILES

C1CCC(CC1)(C(=O)OCC(=O)N2CCN(CC2)C3=NC=CC=N3)O

InChI

InChI=1S/C17H24N4O4/c22-14(13-25-15(23)17(24)5-2-1-3-6-17)20-9-11-21(12-10-20)16-18-7-4-8-19-16/h4,7-8,24H,1-3,5-6,9-13H2