O3-tert-butyl O1-methyl (2R)-2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-2-fluoranyl-propanedioate

Systemtic Name: O3-tert-butyl O1-methyl (2R)-2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-2-fluoranyl-propanedioate Openeye Name: O1-tert-butyl O3-methyl (2R)-2-(5-bromo-1,3-dioxo-isoindolin-2-yl)-2-fluoro-propanedioate CAS Name: (2R)-2-(5-bromo-1,3-dioxo-2-isoindolyl)-2-fluoropropanedioic acid O3-tert-butyl ester O1-methyl ester IUPAC Name: 3-O-tert-butyl 1-O-methyl (2R)-2-(5-bromo-1,3-dioxoisoindol-2-yl)-2-fluoropropanedioate Traditional Name: (2R)-2-(5-bromo-1,3-diketo-isoindolin-2-yl)-2-fluoro-malonic acid O1-tert-butyl ester O3-methyl ester Formula: C16H15BrFNO6 MolecularWeight: 416.195803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C(=O)OC)(N1C(=O)C2=C(C1=O)C=C(C=C2)Br)F

Isomeric SMILES

CC(C)(C)OC(=O)[C@](C(=O)OC)(N1C(=O)C2=C(C1=O)C=C(C=C2)Br)F

InChI

InChI=1S/C16H15BrFNO6/c1-15(2,3)25-14(23)16(18,13(22)24-4)19-11(20)9-6-5-8(17)7-10(9)12(19)21/h5-7H,1-4H3/t16-/m0/s1