(4-acetyloxyoxolan-3-yl) 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate

Systemtic Name: (4-acetyloxyoxolan-3-yl) 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate Openeye Name: (4-acetoxytetrahydrofuran-3-yl) 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate CAS Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoic acid (4-acetyloxy-3-oxolanyl) ester IUPAC Name: (4-acetyloxyoxolan-3-yl) 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoate Traditional Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzoic acid (4-acetoxytetrahydrofuran-3-yl) ester Formula: C20H15ClF3NO8 MolecularWeight: 489.78321

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1COCC1OC(=O)C2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OC1COCC1OC(=O)C2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H15ClF3NO8/c1-10(26)31-17-8-30-9-18(17)33-19(27)13-7-12(3-4-15(13)25(28)29)32-16-5-2-11(6-14(16)21)20(22,23)24/h2-7,17-18H,8-9H2,1H3