5-(2-methoxy-5-nitro-phenyl)-3-methyl-3-(trifluoromethyl)-1,2-dihydropyrazole

Systemtic Name: 5-(2-methoxy-5-nitro-phenyl)-3-methyl-3-(trifluoromethyl)-1,2-dihydropyrazole Openeye Name: 5-(2-methoxy-5-nitro-phenyl)-3-methyl-3-(trifluoromethyl)-1,2-dihydropyrazole CAS Name: 5-(2-methoxy-5-nitrophenyl)-3-methyl-3-(trifluoromethyl)-1,2-dihydropyrazole IUPAC Name: 5-(2-methoxy-5-nitrophenyl)-3-methyl-3-(trifluoromethyl)-1,2-dihydropyrazole Traditional Name: 5-(2-methoxy-5-nitro-phenyl)-3-methyl-3-(trifluoromethyl)-3-pyrazoline Formula: C12H12F3N3O3 MolecularWeight: 303.23719

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(NN1)C2=C(C=CC(=C2)[N+](=O)[O-])OC)C(F)(F)F

Isomeric SMILES

CC1(C=C(NN1)C2=C(C=CC(=C2)[N+](=O)[O-])OC)C(F)(F)F

InChI

InChI=1S/C12H12F3N3O3/c1-11(12(13,14)15)6-9(16-17-11)8-5-7(18(19)20)3-4-10(8)21-2/h3-6,16-17H,1-2H3