ethyl (1S)-1-(2-cyano-3-fluoranyl-4-nitro-phenyl)-2-oxidanylidene-cyclopentane-1-carboxylate

Systemtic Name: ethyl (1S)-1-(2-cyano-3-fluoranyl-4-nitro-phenyl)-2-oxidanylidene-cyclopentane-1-carboxylate Openeye Name: ethyl (1S)-1-(2-cyano-3-fluoro-4-nitro-phenyl)-2-oxo-cyclopentanecarboxylate CAS Name: (1S)-1-(2-cyano-3-fluoro-4-nitrophenyl)-2-oxo-1-cyclopentanecarboxylic acid ethyl ester IUPAC Name: ethyl (1S)-1-(2-cyano-3-fluoro-4-nitrophenyl)-2-oxocyclopentane-1-carboxylate Traditional Name: (1S)-1-(2-cyano-3-fluoro-4-nitro-phenyl)-2-keto-cyclopentanecarboxylic acid ethyl ester Formula: C15H13FN2O5 MolecularWeight: 320.272523

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCC1=O)C2=C(C(=C(C=C2)[N+](=O)[O-])F)C#N

Isomeric SMILES

CCOC(=O)[C@@]1(CCCC1=O)C2=C(C(=C(C=C2)[N+](=O)[O-])F)C#N

InChI

InChI=1S/C15H13FN2O5/c1-2-23-14(20)15(7-3-4-12(15)19)10-5-6-11(18(21)22)13(16)9(10)8-17/h5-6H,2-4,7H2,1H3/t15-/m0/s1