ethyl 3-[5-[4-chloranyl-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-2-nitro-phenoxy]propanoate

Systemtic Name: ethyl 3-[5-[4-chloranyl-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-2-nitro-phenoxy]propanoate Openeye Name: ethyl 3-[5-[4-chloro-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-2-nitro-phenoxy]propanoate CAS Name: 3-[5-[[4-chloro-1-methyl-5-(trifluoromethyl)-3-pyrazolyl]oxy]-2-nitrophenoxy]propanoic acid ethyl ester IUPAC Name: ethyl 3-[5-[4-chloro-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-2-nitrophenoxy]propanoate Traditional Name: 3-[5-[4-chloro-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-2-nitro-phenoxy]propionic acid ethyl ester Formula: C16H15ClF3N3O6 MolecularWeight: 437.75501

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCOC1=C(C=CC(=C1)OC2=NN(C(=C2Cl)C(F)(F)F)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCOC1=C(C=CC(=C1)OC2=NN(C(=C2Cl)C(F)(F)F)C)[N+](=O)[O-]

InChI

InChI=1S/C16H15ClF3N3O6/c1-3-27-12(24)6-7-28-11-8-9(4-5-10(11)23(25)26)29-15-13(17)14(16(18,19)20)22(2)21-15/h4-5,8H,3,6-7H2,1-2H3