[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl] 2-chloranyl-4,5-bis(fluoranyl)benzoate

Systemtic Name: [2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl] 2-chloranyl-4,5-bis(fluoranyl)benzoate Openeye Name: [2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 2-chloro-4,5-difluoro-benzoate CAS Name: 2-chloro-4,5-difluorobenzoic acid [2-oxo-2-(4-phenyl-1-piperazinyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 2-chloro-4,5-difluorobenzoate Traditional Name: 2-chloro-4,5-difluoro-benzoic acid [2-keto-2-(4-phenylpiperazino)ethyl] ester Formula: C19H17ClF2N2O3 MolecularWeight: 394.799686

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)COC(=O)C3=CC(=C(C=C3Cl)F)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)COC(=O)C3=CC(=C(C=C3Cl)F)F

InChI

InChI=1S/C19H17ClF2N2O3/c20-15-11-17(22)16(21)10-14(15)19(26)27-12-18(25)24-8-6-23(7-9-24)13-4-2-1-3-5-13/h1-5,10-11H,6-9,12H2