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

Systemtic Name: (2-methyloxolan-3-yl)methyl 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate Openeye Name: (2-methyltetrahydrofuran-3-yl)methyl 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate CAS Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoic acid (2-methyl-3-oxolanyl)methyl ester IUPAC Name: (2-methyloxolan-3-yl)methyl 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoate Traditional Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzoic acid (2-methyltetrahydrofuran-3-yl)methyl ester Formula: C20H17ClF3NO6 MolecularWeight: 459.80029

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CCO1)COC(=O)C2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1C(CCO1)COC(=O)C2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H17ClF3NO6/c1-11-12(6-7-29-11)10-30-19(26)15-9-14(3-4-17(15)25(27)28)31-18-5-2-13(8-16(18)21)20(22,23)24/h2-5,8-9,11-12H,6-7,10H2,1H3