[1-[(4-fluoranyl-3-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl] 2,4,5-trimethylfuran-3-carboxylate

Systemtic Name: [1-[(4-fluoranyl-3-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl] 2,4,5-trimethylfuran-3-carboxylate Openeye Name: [2-(4-fluoro-3-nitro-anilino)-1-methyl-2-oxo-ethyl] 2,4,5-trimethylfuran-3-carboxylate CAS Name: 2,4,5-trimethyl-3-furancarboxylic acid [1-(4-fluoro-3-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-fluoro-3-nitroanilino)-1-oxopropan-2-yl] 2,4,5-trimethylfuran-3-carboxylate Traditional Name: 2,4,5-trimethylfuran-3-carboxylic acid [2-(4-fluoro-3-nitro-anilino)-2-keto-1-methyl-ethyl] ester Formula: C17H17FN2O6 MolecularWeight: 364.325083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1C(=O)OC(C)C(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=C(OC(=C1C(=O)OC(C)C(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-])C)C

InChI

InChI=1S/C17H17FN2O6/c1-8-9(2)25-10(3)15(8)17(22)26-11(4)16(21)19-12-5-6-13(18)14(7-12)20(23)24/h5-7,11H,1-4H3,(H,19,21)