1-[(3-fluoranyl-4-methoxy-phenyl)methyl]-3,5-dimethyl-4-nitro-pyrazole

Systemtic Name: 1-[(3-fluoranyl-4-methoxy-phenyl)methyl]-3,5-dimethyl-4-nitro-pyrazole Openeye Name: 1-[(3-fluoro-4-methoxy-phenyl)methyl]-3,5-dimethyl-4-nitro-pyrazole CAS Name: 1-[(3-fluoro-4-methoxyphenyl)methyl]-3,5-dimethyl-4-nitropyrazole IUPAC Name: 1-[(3-fluoro-4-methoxyphenyl)methyl]-3,5-dimethyl-4-nitropyrazole Traditional Name: 1-(3-fluoro-4-methoxy-benzyl)-3,5-dimethyl-4-nitro-pyrazole Formula: C13H14FN3O3 MolecularWeight: 279.266963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=C(C=C2)OC)F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=C(C=C2)OC)F)C)[N+](=O)[O-]

InChI

InChI=1S/C13H14FN3O3/c1-8-13(17(18)19)9(2)16(15-8)7-10-4-5-12(20-3)11(14)6-10/h4-6H,7H2,1-3H3