butyl 2-(5-fluoranyl-2,4-dinitro-phenoxy)ethanoate

Systemtic Name: butyl 2-(5-fluoranyl-2,4-dinitro-phenoxy)ethanoate Openeye Name: butyl 2-(5-fluoro-2,4-dinitro-phenoxy)acetate CAS Name: 2-(5-fluoro-2,4-dinitrophenoxy)acetic acid butyl ester IUPAC Name: butyl 2-(5-fluoro-2,4-dinitrophenoxy)acetate Traditional Name: 2-(5-fluoro-2,4-dinitro-phenoxy)acetic acid butyl ester Formula: C12H13FN2O7 MolecularWeight: 316.239223

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)COC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])F

Isomeric SMILES

CCCCOC(=O)COC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])F

InChI

InChI=1S/C12H13FN2O7/c1-2-3-4-21-12(16)7-22-11-5-8(13)9(14(17)18)6-10(11)15(19)20/h5-6H,2-4,7H2,1H3