ethyl 2-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]-2-pyrazol-1-yl-propanoate

Systemtic Name: ethyl 2-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]-2-pyrazol-1-yl-propanoate Openeye Name: ethyl 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]-2-pyrazol-1-yl-propanoate CAS Name: 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenoxy]-2-(1-pyrazolyl)propanoic acid ethyl ester IUPAC Name: ethyl 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenoxy]-2-pyrazol-1-ylpropanoate Traditional Name: 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]-2-pyrazol-1-yl-propionic acid ethyl ester Formula: C21H17ClF3N3O6 MolecularWeight: 499.82439

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(N1C=CC=N1)OC2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(C)(N1C=CC=N1)OC2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H17ClF3N3O6/c1-3-32-19(29)20(2,27-10-4-9-26-27)34-18-12-14(6-7-16(18)28(30)31)33-17-8-5-13(11-15(17)22)21(23,24)25/h4-12H,3H2,1-2H3