ethyl 3-(5-fluoranyl-1-benzofuran-2-yl)-4-nitro-butanoate

Systemtic Name: ethyl 3-(5-fluoranyl-1-benzofuran-2-yl)-4-nitro-butanoate Openeye Name: ethyl 3-(5-fluorobenzofuran-2-yl)-4-nitro-butanoate CAS Name: 3-(5-fluoro-2-benzofuranyl)-4-nitrobutanoic acid ethyl ester IUPAC Name: ethyl 3-(5-fluoro-1-benzofuran-2-yl)-4-nitrobutanoate Traditional Name: 3-(5-fluorobenzofuran-2-yl)-4-nitro-butyric acid ethyl ester Formula: C14H14FNO5 MolecularWeight: 295.263063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C[N+](=O)[O-])C1=CC2=C(O1)C=CC(=C2)F

Isomeric SMILES

CCOC(=O)CC(C[N+](=O)[O-])C1=CC2=C(O1)C=CC(=C2)F

InChI

InChI=1S/C14H14FNO5/c1-2-20-14(17)7-10(8-16(18)19)13-6-9-5-11(15)3-4-12(9)21-13/h3-6,10H,2,7-8H2,1H3