4-chloranyl-3-(3-ethoxy-4-nitro-phenoxy)-1-methyl-5-(trifluoromethyl)pyrazole

Systemtic Name: 4-chloranyl-3-(3-ethoxy-4-nitro-phenoxy)-1-methyl-5-(trifluoromethyl)pyrazole Openeye Name: 4-chloro-3-(3-ethoxy-4-nitro-phenoxy)-1-methyl-5-(trifluoromethyl)pyrazole CAS Name: 4-chloro-3-(3-ethoxy-4-nitrophenoxy)-1-methyl-5-(trifluoromethyl)pyrazole IUPAC Name: 4-chloro-3-(3-ethoxy-4-nitrophenoxy)-1-methyl-5-(trifluoromethyl)pyrazole Traditional Name: 4-chloro-3-(3-ethoxy-4-nitro-phenoxy)-1-methyl-5-(trifluoromethyl)pyrazole Formula: C13H11ClF3N3O4 MolecularWeight: 365.69235

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11ClF3N3O4/c1-3-23-9-6-7(4-5-8(9)20(21)22)24-12-10(14)11(13(15,16)17)19(2)18-12/h4-6H,3H2,1-2H3