5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-3-(4-fluorophenyl)-1,2,4-oxadiazole

Systemtic Name: 5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-3-(4-fluorophenyl)-1,2,4-oxadiazole Openeye Name: 5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-3-(4-fluorophenyl)-1,2,4-oxadiazole CAS Name: 5-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-3-(4-fluorophenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-3-(4-fluorophenyl)-1,2,4-oxadiazole Traditional Name: 5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-3-(4-fluorophenyl)-1,2,4-oxadiazole Formula: C14H12FN5O3 MolecularWeight: 317.275183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=NC(=NO2)C3=CC=C(C=C3)F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=NC(=NO2)C3=CC=C(C=C3)F)C)[N+](=O)[O-]

InChI

InChI=1S/C14H12FN5O3/c1-8-13(20(21)22)9(2)19(17-8)7-12-16-14(18-23-12)10-3-5-11(15)6-4-10/h3-6H,7H2,1-2H3