(2-chloranylcyclohexyl) 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate

Systemtic Name: (2-chloranylcyclohexyl) 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate Openeye Name: (2-chlorocyclohexyl) 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate CAS Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoic acid (2-chlorocyclohexyl) ester IUPAC Name: (2-chlorocyclohexyl) 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoate Traditional Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzoic acid (2-chlorocyclohexyl) ester Formula: C20H16Cl2F3NO5 MolecularWeight: 478.24595

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)OC(=O)C2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCC(C(C1)OC(=O)C2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H16Cl2F3NO5/c21-14-3-1-2-4-17(14)31-19(27)13-10-12(6-7-16(13)26(28)29)30-18-8-5-11(9-15(18)22)20(23,24)25/h5-10,14,17H,1-4H2