[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 2-(2-chloranyl-6-fluoranyl-phenyl)ethanoate

Systemtic Name: [2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 2-(2-chloranyl-6-fluoranyl-phenyl)ethanoate Openeye Name: [2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 2-(2-chloro-6-fluoro-phenyl)acetate CAS Name: 2-(2-chloro-6-fluorophenyl)acetic acid [2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl] ester IUPAC Name: [2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 2-(2-chloro-6-fluorophenyl)acetate Traditional Name: 2-(2-chloro-6-fluoro-phenyl)acetic acid [2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl] ester Formula: C18H18ClFN4O3 MolecularWeight: 392.811923

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)COC(=O)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)COC(=O)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C18H18ClFN4O3/c19-14-3-1-4-15(20)13(14)11-17(26)27-12-16(25)23-7-9-24(10-8-23)18-21-5-2-6-22-18/h1-6H,7-12H2