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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-5-(4-bromanyl-3-nitro-1H-pyrazol-5-yl)-1,3,4-oxadiazole Openeye Name: 2-(1,3-benzodioxol-5-yl)-5-(4-bromo-3-nitro-1H-pyrazol-5-yl)-1,3,4-oxadiazole CAS Name: 2-(1,3-benzodioxol-5-yl)-5-(4-bromo-3-nitro-1H-pyrazol-5-yl)-1,3,4-oxadiazole IUPAC Name: 2-(1,3-benzodioxol-5-yl)-5-(4-bromo-3-nitro-1H-pyrazol-5-yl)-1,3,4-oxadiazole Traditional Name: 2-(1,3-benzodioxol-5-yl)-5-(4-bromo-3-nitro-1H-pyrazol-5-yl)-1,3,4-oxadiazole Formula: C12H6BrN5O5 MolecularWeight: 380.11054

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NN=C(O3)C4=C(C(=NN4)[N+](=O)[O-])Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NN=C(O3)C4=C(C(=NN4)[N+](=O)[O-])Br

InChI

InChI=1S/C12H6BrN5O5/c13-8-9(14-15-10(8)18(19)20)12-17-16-11(23-12)5-1-2-6-7(3-5)22-4-21-6/h1-3H,4H2,(H,14,15)