6-(dimethylcarbamoyloxy)hexyl 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate

Systemtic Name: 6-(dimethylcarbamoyloxy)hexyl 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate Openeye Name: 6-(dimethylcarbamoyloxy)hexyl 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate CAS Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoic acid 6-[dimethylamino(oxo)methoxy]hexyl ester IUPAC Name: 6-(dimethylcarbamoyloxy)hexyl 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoate Traditional Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzoic acid 6-(dimethylcarbamoyloxy)hexyl ester Formula: C23H24ClF3N2O7 MolecularWeight: 532.89407

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)OCCCCCCOC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=O)OCCCCCCOC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H24ClF3N2O7/c1-28(2)22(31)35-12-6-4-3-5-11-34-21(30)17-14-16(8-9-19(17)29(32)33)36-20-10-7-15(13-18(20)24)23(25,26)27/h7-10,13-14H,3-6,11-12H2,1-2H3