tert-butyl 2-[2,3-bis(fluoranyl)-6-nitro-phenyl]-3-oxidanylidene-butanoate

Systemtic Name: tert-butyl 2-[2,3-bis(fluoranyl)-6-nitro-phenyl]-3-oxidanylidene-butanoate Openeye Name: tert-butyl 2-(2,3-difluoro-6-nitro-phenyl)-3-oxo-butanoate CAS Name: 2-(2,3-difluoro-6-nitrophenyl)-3-oxobutanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-(2,3-difluoro-6-nitrophenyl)-3-oxobutanoate Traditional Name: 2-(2,3-difluoro-6-nitro-phenyl)-3-keto-butyric acid tert-butyl ester Formula: C14H15F2NO5 MolecularWeight: 315.269406

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C1=C(C=CC(=C1F)F)[N+](=O)[O-])C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)C(C1=C(C=CC(=C1F)F)[N+](=O)[O-])C(=O)OC(C)(C)C

InChI

InChI=1S/C14H15F2NO5/c1-7(18)10(13(19)22-14(2,3)4)11-9(17(20)21)6-5-8(15)12(11)16/h5-6,10H,1-4H3