[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 3-[bis(fluoranyl)methoxy]benzoate

Systemtic Name: [2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 3-[bis(fluoranyl)methoxy]benzoate Openeye Name: [2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 3-(difluoromethoxy)benzoate CAS Name: 3-(difluoromethoxy)benzoic acid [2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl] ester IUPAC Name: [2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 3-(difluoromethoxy)benzoate Traditional Name: 3-(difluoromethoxy)benzoic acid [2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl] ester Formula: C18H18F2N4O4 MolecularWeight: 392.356726

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)COC(=O)C3=CC(=CC=C3)OC(F)F

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)COC(=O)C3=CC(=CC=C3)OC(F)F

InChI

InChI=1S/C18H18F2N4O4/c19-17(20)28-14-4-1-3-13(11-14)16(26)27-12-15(25)23-7-9-24(10-8-23)18-21-5-2-6-22-18/h1-6,11,17H,7-10,12H2