5-(3,4-dimethoxy-5-nitro-phenyl)-3-(1-oxidanidylpyridin-1-ium-3-yl)-1,2,4-oxadiazole

Systemtic Name: 5-(3,4-dimethoxy-5-nitro-phenyl)-3-(1-oxidanidylpyridin-1-ium-3-yl)-1,2,4-oxadiazole Openeye Name: 5-(3,4-dimethoxy-5-nitro-phenyl)-3-(1-oxidopyridin-1-ium-3-yl)-1,2,4-oxadiazole CAS Name: 5-(3,4-dimethoxy-5-nitrophenyl)-3-(1-oxido-3-pyridin-1-iumyl)-1,2,4-oxadiazole IUPAC Name: 5-(3,4-dimethoxy-5-nitrophenyl)-3-(1-oxidopyridin-1-ium-3-yl)-1,2,4-oxadiazole Traditional Name: 5-(3,4-dimethoxy-5-nitro-phenyl)-3-(1-oxidopyridin-1-ium-3-yl)-1,2,4-oxadiazole Formula: C15H12N4O6 MolecularWeight: 344.27898

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)[N+](=O)[O-])C2=NC(=NO2)C3=C[N+](=CC=C3)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)[N+](=O)[O-])C2=NC(=NO2)C3=C[N+](=CC=C3)[O-]

InChI

InChI=1S/C15H12N4O6/c1-23-12-7-10(6-11(19(21)22)13(12)24-2)15-16-14(17-25-15)9-4-3-5-18(20)8-9/h3-8H,1-2H3