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

Systemtic Name: 5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-3-phenyl-1,2,4-oxadiazole Openeye Name: 5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-3-phenyl-1,2,4-oxadiazole CAS Name: 5-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-3-phenyl-1,2,4-oxadiazole IUPAC Name: 5-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-3-phenyl-1,2,4-oxadiazole Traditional Name: 5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-3-phenyl-1,2,4-oxadiazole Formula: C14H13N5O3 MolecularWeight: 299.28472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N5O3/c1-9-13(19(20)21)10(2)18(16-9)8-12-15-14(17-22-12)11-6-4-3-5-7-11/h3-7H,8H2,1-2H3