3-(1,3-benzodioxol-5-yl)-5-(1-methyl-5-nitro-pyrazol-3-yl)-1,2,4-oxadiazole

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-5-(1-methyl-5-nitro-pyrazol-3-yl)-1,2,4-oxadiazole Openeye Name: 3-(1,3-benzodioxol-5-yl)-5-(1-methyl-5-nitro-pyrazol-3-yl)-1,2,4-oxadiazole CAS Name: 3-(1,3-benzodioxol-5-yl)-5-(1-methyl-5-nitro-3-pyrazolyl)-1,2,4-oxadiazole IUPAC Name: 3-(1,3-benzodioxol-5-yl)-5-(1-methyl-5-nitropyrazol-3-yl)-1,2,4-oxadiazole Traditional Name: 3-(1,3-benzodioxol-5-yl)-5-(1-methyl-5-nitro-pyrazol-3-yl)-1,2,4-oxadiazole Formula: C13H9N5O5 MolecularWeight: 315.24106

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C2=NC(=NO2)C3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CC(=N1)C2=NC(=NO2)C3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

InChI

InChI=1S/C13H9N5O5/c1-17-11(18(19)20)5-8(15-17)13-14-12(16-23-13)7-2-3-9-10(4-7)22-6-21-9/h2-5H,6H2,1H3