[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-4-oxidanyl-oxolan-2-yl] benzoate

Systemtic Name: [5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-4-oxidanyl-oxolan-2-yl] benzoate Openeye Name: [5-[2-chloro-4-(trifluoromethyl)phenoxy]-4-hydroxy-2-nitro-tetrahydrofuran-2-yl] benzoate CAS Name: benzoic acid [5-[2-chloro-4-(trifluoromethyl)phenoxy]-4-hydroxy-2-nitro-2-oxolanyl] ester IUPAC Name: [5-[2-chloro-4-(trifluoromethyl)phenoxy]-4-hydroxy-2-nitrooxolan-2-yl] benzoate Traditional Name: benzoic acid [5-[2-chloro-4-(trifluoromethyl)phenoxy]-4-hydroxy-2-nitro-tetrahydrofuran-2-yl] ester Formula: C18H13ClF3NO7 MolecularWeight: 447.74653

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1([N+](=O)[O-])OC(=O)C2=CC=CC=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)O

Isomeric SMILES

C1C(C(OC1([N+](=O)[O-])OC(=O)C2=CC=CC=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)O

InChI

InChI=1S/C18H13ClF3NO7/c19-12-8-11(18(20,21)22)6-7-14(12)28-16-13(24)9-17(30-16,23(26)27)29-15(25)10-4-2-1-3-5-10/h1-8,13,16,24H,9H2