1-ethoxypropan-2-yl 2-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]ethanoate

Systemtic Name: 1-ethoxypropan-2-yl 2-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]ethanoate Openeye Name: (2-ethoxy-1-methyl-ethyl) 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]acetate CAS Name: 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenyl]acetic acid 1-ethoxypropan-2-yl ester IUPAC Name: 1-ethoxypropan-2-yl 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenyl]acetate Traditional Name: 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]acetic acid (2-ethoxy-1-methyl-ethyl) ester Formula: C20H19ClF3NO6 MolecularWeight: 461.81617

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(C)OC(=O)CC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOCC(C)OC(=O)CC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H19ClF3NO6/c1-3-29-11-12(2)30-19(26)9-13-8-15(5-6-17(13)25(27)28)31-18-7-4-14(10-16(18)21)20(22,23)24/h4-8,10,12H,3,9,11H2,1-2H3