4-chloranyl-1-methyl-3-[3-(2-methylpropoxy)-4-nitro-phenoxy]-5-(trifluoromethyl)pyrazole

Systemtic Name: 4-chloranyl-1-methyl-3-[3-(2-methylpropoxy)-4-nitro-phenoxy]-5-(trifluoromethyl)pyrazole Openeye Name: 4-chloro-3-(3-isobutoxy-4-nitro-phenoxy)-1-methyl-5-(trifluoromethyl)pyrazole CAS Name: 4-chloro-1-methyl-3-[3-(2-methylpropoxy)-4-nitrophenoxy]-5-(trifluoromethyl)pyrazole IUPAC Name: 4-chloro-1-methyl-3-[3-(2-methylpropoxy)-4-nitrophenoxy]-5-(trifluoromethyl)pyrazole Traditional Name: 4-chloro-3-(3-isobutoxy-4-nitro-phenoxy)-1-methyl-5-(trifluoromethyl)pyrazole Formula: C15H15ClF3N3O4 MolecularWeight: 393.74551

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=CC(=C1)OC2=NN(C(=C2Cl)C(F)(F)F)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)COC1=C(C=CC(=C1)OC2=NN(C(=C2Cl)C(F)(F)F)C)[N+](=O)[O-]

InChI

InChI=1S/C15H15ClF3N3O4/c1-8(2)7-25-11-6-9(4-5-10(11)22(23)24)26-14-12(16)13(15(17,18)19)21(3)20-14/h4-6,8H,7H2,1-3H3